SCHEMBL120876

SCHEMBL120876

CC1CCN(c2nc3ncnn3cc2-c2c(F)cc(F)cc2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 4/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
HTT P42858 1/20 0.33
PTK2B Q14289 1/20 0.33
TSHR P16473 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 2/20 0.32
LCK P06239 1/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL4815038 0.78 TSHR (0.42) TP53MAPTLMNAALDH1A1GAA
SCHEMBL3398384 0.74 TSHR (0.39) TP53MAPTLMNAALDH1A1GAA
SCHEMBL5096873 0.73 PDE2A (0.39) LMNAALDH1A1EGLN2TSHRGLA
SCHEMBL16996752 0.72 MAPK1 (0.37) ALDH1A1GAACYP2C19KDM4EMAPK1
SCHEMBL976406 0.71 LMNA (0.47) TP53MAPTLMNAALDH1A1GAA
SCHEMBL81282 0.70 TSHR (0.41) MAPTLMNAALDH1A1GAAEGLN2
SCHEMBL5460885 0.69 TSHR (0.40) MAPTLMNAALDH1A1GAAKDM4E
SCHEMBL3471316 0.68 HSD17B10 (0.38) MAPTLMNAALDH1A1GAACYP2C19
SCHEMBL5462930 0.68 EGLN2 (0.44) MAPTLMNAALDH1A1GAAKDM4E
SCHEMBL1352687 0.68 KDM4E (0.34) ALDH1A1GAACYP2C19KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150250173-A1 PESTICIDALLY ACTIVE MIXTURES COMPRISING ANTHRANILAMIDE COMPOUNDS BASF SE (DE) 2015-09-10 US claimed
WO-2015055497-A1 SUBSTITUTED PESTICIDAL PYRAZOLE COMPOUNDS BASF SE (DE) 2015-04-23 WO claimed
EP-2470007-A2 FOAMABLE PESTICIDE COMPOSITIONS AND METHODS OF APPLICATION BASF Corporation (US) 2012-07-04 EP claimed
EP-2424370-A2 FOAMABLE PESTICIDE COMPOSITIONS BASF Corporation (US) 2012-03-07 EP claimed
WO-2010129345-A2 FOAMABLE PESTICIDE COMPOSITIONS BASF CORPORATION (US) 2010-11-11 WO claimed
EP-2699563-B3 NOVEL PESTICIDAL PYRAZOLE COMPOUNDS BASF SE (DE) 2024-06-12 EP disclosed
EP-2984089-B1 SUBSTITUTED PYRIMIDINIUM COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS BASF SE (DE) 2022-03-09 EP disclosed
US-11019820-B2 Substituted pyrimidinium compounds and derivatives for combating animal pests BASF SE (DE) 2021-06-01 US disclosed
US-10798946-B2 Method for managing flea beetles of the family chrysomelidae in Brassica crops BASF AGROCHEMICAL PRODUCTS B.V. (NL) 2020-10-13 US disclosed
US-10757938-B2 N-acylimino Heterocyclic Compounds BASF SE (DE) 2020-09-01 US disclosed
EP-3013808-B1 ISOTHIAZOLINE COMPOUNDS SUBSTITUTED WITH A CARBOBICYCLIC GROUP BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2020-04-15 EP disclosed
EP-3013807-B1 NAPHTHYL-SUBSTITUTED ISOTHIAZOLINE COMPOUNDS BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2020-04-08 EP disclosed
EP-2501686-A1 FLUORINATED OXA OR THIA HETEROARYLALKYLSULFIDE DERIVATIVES FOR COMBATING INVERTEBRATE PESTS Merial Limited (US) 2012-09-26 EP disclosed
EP-2480537-A1 AMINOQUINAZOLINE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2012-08-01 EP disclosed
US-20120178622-A1 Aminoquinazoline Compounds for Combating Invertebrate Pests BASF SE (DE) 2012-07-12 US disclosed
WO-2012076704-A2 PYRAZOLE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS BASF SE (DE) 2012-06-14 WO disclosed
WO-2012042006-A1 IMINE COMPOUNDS BASF SE (DE) 2012-04-05 WO disclosed
WO-2012042007-A1 IMINE SUBSTITUTED 2, 4 - DIARYL - PYRROLINE DERIVATIVES AS PESTICIDES BASF SE (DE) 2012-04-05 WO disclosed
WO-2012007426-A1 AZOLINE SUBSTITUTED ISOXAZOLINE BENZAMIDE COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2012-01-19 WO disclosed
WO-2010075994-A1 TREATMENT OF TRANSGENIC CROPS WITH MIXTURES OF FIPROLES AND CHLORONICOTINYLS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-07-08 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 (4 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-10757938-B2 N-acylimino Heterocyclic Compounds NR4A1, NR0B1, NR0B2 TP53 4856/4885MAPT 4438/4885LMNA 1687/4885
US-11019820-B2 Substituted pyrimidinium compounds and derivatives for combating animal pests THOP1, PRDX2, PRDX1 TP53 4478/4885MAPT 2152/4885LMNA 2959/4885
US-20150250173-A1 PESTICIDALLY ACTIVE MIXTURES COMPRISING ANTHRANILAMIDE COMPOUNDS AADAC, ARSA, SIRT7 TP53 2976/4885MAPT 3813/4885LMNA 4434/4885
US-20120178622-A1 Aminoquinazoline Compounds for Combating Invertebrate Pests AAAS, ATL3, H1-3 TP53 3819/4885MAPT 3682/4885LMNA 2489/4885

“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.