SCHEMBL343589

SCHEMBL343589

CO/N=C/c1ccc(-c2ccccc2NC(=O)c2cn(C)nc2C(F)F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 5/20 0.39
LMNA P02545 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 1/20 0.38
NTRK1 P04629 2/20 0.38
TSHR P16473 1/20 0.37
IRAK4 Q9NWZ3 3/20 0.37
ATM Q13315 1/20 0.36
POLB P06746 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 1/20 0.35
BLM P54132 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL343590 1.00 CHRM3 (0.39) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL10213365 0.90 ATM (0.48) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL9979704 0.88 ALDH1A1 (0.41) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL23748525 0.88 ALDH1A1 (0.41) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL9979548 0.88 ALDH1A1 (0.41) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL343329 0.87 NTRK1 (0.43) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL343328 0.87 NTRK1 (0.43) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL12855875 0.87 NTRK1 (0.40) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL4793286 0.84 CHRM3 (0.48) CHRM3LMNAKDM4EALDH1A1MAPT
SCHEMBL3680102 0.82 CHRM3 (0.42) CHRM3LMNAKDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 150 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140213557-A1 Active Compound Combinations BAYER CROPSCIENCE AG (DE) 2014-07-31 US claimed
US-20110166109-A1 Synergistic Active Compound Combinations Comprising Phenyltriazoles BAYER CROPSCIENCE AG (DE) 2011-07-07 US claimed
US-20110152097-A1 Active Compound Combinations BAYER CROPSCIENCE AG (DE) 2011-06-23 US claimed
EP-2255651-A2 Agent combinations Bayer CropScience AG (DE) 2010-12-01 EP claimed
EP-2255644-A2 Agent combinations Bayer CropScience AG (DE) 2010-12-01 EP claimed
US-20100190645-A1 SYNERGISTIC FUNGICIDAL ACTIVE COMPOUND COMBINATIONS COMPRISING FORMONONETIN PLANT HEALTH CARE, INC. 2010-07-29 US claimed
EP-2132989-A2 Agent combinations Bayer CropScience AG (DE) 2009-12-16 EP claimed
US-20090286681-A1 Synergistic Fungicidal Active Compounde Combinations Containing a Carboxamide, an Azole, a Second Azole or a Strobilurin BAYER CROPSCIENCE AG (DE) 2009-11-19 US claimed
US-20090280981-A1 SYNERGISTIC ACTIVE INGREDIENT COMBINATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-11-12 US claimed
US-20090105311-A1 Carboxamides BAYER CROPSCIENCE AG (DE) 2009-04-23 US claimed
US-20090018015-A1 Synergistic Fungicidal Active Combinations BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2009-01-15 US claimed
US-20080269263-A1 Synergistic Fungidical Active Substance Combinations BAYER CROPSCIENCE AG (DE) 2008-10-30 US claimed
US-11578051-B2 Thiophene carboxamide derivative and plant disease control agent comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2023-02-14 US disclosed
US-20210347755-A1 THIOPHENE CARBOXAMIDE DERIVATIVE AND PLANT DISEASE CONTROL AGENT COMPRISING SAME FARMHANNONG CO., LTD (KR) 2021-11-11 US disclosed
EP-3865479-A1 THIOPHENE CARBOXAMIDE DERIVATIVE AND PLANT DISEASE CONTROL AGENT COMPRISING SAME Korea Research Institute of Chemical Technology (KR) 2021-08-18 EP disclosed
US-20190174759-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2019-06-13 US disclosed
WO-2007031141-A1 SYNERGISTIC FUNGICIDAL ACTIVE SUBSTANCE COMBINATIONS CONTAINING A CARBOXAMIDE, AN AZOLE, A SECOND AZOLE OR A STROBILURINE BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-03-22 WO disclosed
US-20070060579-A1 Synergistic fungicidal active substance combinations BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2007-03-15 US disclosed
US-7176228-B2 Pyrazole biphenylcarboxamides BAYER CROPSCIENCE AG (DE) 2007-02-13 US disclosed
US-7176228-B2 Pyrazole biphenylcarboxamides BAYER CROPSCIENCE AG (DE) 2007-02-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190174759-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATIONS DDT, CYP4X1, CYP51A1 CHRM3 1157/4885LMNA 4675/4885KDM4E 2075/4885
US-20110152097-A1 Active Compound Combinations AGXT, GLUL, GMNN CHRM3 4343/4885LMNA 3752/4885KDM4E 2720/4885
US-20080269263-A1 Synergistic Fungidical Active Substance Combinations ERG28, MANBA, MAN2A1 CHRM3 765/4885LMNA 2739/4885KDM4E 4171/4885
US-20090018015-A1 Synergistic Fungicidal Active Combinations CYP51A1, CYP1A2, CYP3A7 CHRM3 158/4885LMNA 4622/4885KDM4E 1681/4885
US-20090105311-A1 Carboxamides NAAA, CBR3, CNR1 CHRM3 1775/4885LMNA 2376/4885KDM4E 708/4885
US-20140213557-A1 Active Compound Combinations AGXT, GLUL, GMNN CHRM3 4343/4885LMNA 3752/4885KDM4E 2720/4885
US-20210347755-A1 THIOPHENE CARBOXAMIDE DERIVATIVE AND PLANT DISEASE CONTROL AGENT COMPRISING SAME BROX, GTF3C4, GTF3C2 CHRM3 1553/4885LMNA 4707/4885KDM4E 46/4885
US-11578051-B2 Thiophene carboxamide derivative and plant disease control agent comprising same BROX, GTF3C4, GTF3C2 CHRM3 1553/4885LMNA 4707/4885KDM4E 46/4885
US-20110166109-A1 Synergistic Active Compound Combinations Comprising Phenyltriazoles NAT1, ACAT1, CAT CHRM3 1739/4885LMNA 4847/4885KDM4E 3338/4885
US-20070060579-A1 Synergistic fungicidal active substance combinations CYP51A1, CYP1A2, CYP4X1 CHRM3 94/4885LMNA 4276/4885KDM4E 3408/4885
US-20090286681-A1 Synergistic Fungicidal Active Compounde Combinations Containing a Carboxamide, an Azole, a Second Azole or a Strobilurin MGAM, SUCLG1, MGAM2 CHRM3 3685/4885LMNA 4144/4885KDM4E 430/4885
US-20100190645-A1 SYNERGISTIC FUNGICIDAL ACTIVE COMPOUND COMBINATIONS COMPRISING FORMONONETIN CYP51A1, ERG28, CYP3A7 CHRM3 3444/4885LMNA 4150/4885KDM4E 2977/4885
US-20090280981-A1 SYNERGISTIC ACTIVE INGREDIENT COMBINATIONS CYP51A1, ERG28, CYP4X1 CHRM3 1259/4885LMNA 3763/4885KDM4E 2064/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.