SCHEMBL5078613

SCHEMBL5078613

CC(C)CC(C)c1sccc1NC(=O)c1ccccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
LMNA P02545 2/20 0.48
RAB9A P51151 4/20 0.46
CYP3A4 P08684 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 3/20 0.45
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
DCTPP1 Q9H773 1/20 0.43
GRM4 Q14833 2/20 0.42

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
SCHEMBL8444052 0.86 F2R (0.45) HPGDCYP2C19ALDH1A1MEN1KMT2A
SCHEMBL12798649 0.86 CYP1A2 (0.48) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL5179116 0.86 HPGD (0.48) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL8357735 0.84 NPC1 (0.55) HPGDALDH1A1MEN1KMT2ARAB9A
SCHEMBL5634500 0.82 L3MBTL1 (0.52) HPGDALDH1A1MEN1KMT2ALMNA
SCHEMBL13292672 0.81 PRNP (0.36) HPGDALDH1A1MEN1KMT2ALMNA
SCHEMBL4831743 0.80 HPGD (0.59) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL17999737 0.76 ALDH1A1 (0.35) HPGDALDH1A1MEN1KMT2ALMNA
SCHEMBL442079 0.75 ATM (0.51) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL13851050 0.74 ATM (0.37) CYP1A2ALDH1A1MEN1KMT2ALMNA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160227778-A1 SEED DRESSING FOR CONTROLLING PHYTOPATHOGENIC FUNGI BAYER IP GMBH (DE) 2016-08-11 US disclosed
US-20160227778-A1 SEED DRESSING FOR CONTROLLING PHYTOPATHOGENIC FUNGI BAYER IP GMBH (DE) 2016-08-11 US disclosed
US-20080139389-A1 Seed Dressing for Controlling Phytopathogenic Fungi BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-06-12 US disclosed
US-20080139389-A1 Seed Dressing for Controlling Phytopathogenic Fungi BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-06-12 US disclosed
US-20080139389-A1 Seed Dressing for Controlling Phytopathogenic Fungi BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-06-12 US disclosed
EP-1761128-A2 PROTECTANT FOR CONTROLLING PHYTOPATHOGENIC FUNGI Bayer CropScience Aktiengesellschaft (DE) 2007-03-14 EP disclosed
WO-2005122770-A2 PROTECTANT FOR CONTROLLING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2005-12-29 WO 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 (2 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-20160227778-A1 SEED DRESSING FOR CONTROLLING PHYTOPATHOGENIC FUNGI DPM1, MGAM, SUCLG1 HPGD 2254/4885CYP1A2 775/4885CYP2C19 1850/4885
US-20080139389-A1 Seed Dressing for Controlling Phytopathogenic Fungi DPM1, MGAM, SUCLG1 HPGD 2254/4885CYP1A2 775/4885CYP2C19 1850/4885

“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.