SCHEMBL14636146

SCHEMBL14636146

FC(F)(F)c1nc(-c2cccnc2)sc1-c1cc[nH]n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
CYP19A1 P11511 3/20 0.39
AXL P30530 1/20 0.39
PBRM1 Q86U86 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP2A6 P11509 1/20 0.38
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.37
PTGS2 P35354 1/20 0.37
PIM1 P11309 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL15999643 0.81 CYP2A6 (0.53) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL1680228 0.81 CYP3A4 (0.49) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL14654152 0.79 CYP19A1 (0.45) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL14635624 0.78 ALOX5 (0.50) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL14654174 0.77 ALOX5 (0.41) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL12277978 0.76 KDM4E (0.54) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL14654146 0.75 CYP2A6 (0.46) ALOX5RAB9ANPC1CYP19A1CYP2A6
SCHEMBL14636103 0.74 ALOX5 (0.41) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL15999644 0.74 ALOX5 (0.40) ALOX5RAB9ANPC1CYP19A1AXL
SCHEMBL446537 0.72 METAP2 (0.56) CYP19A1AXLPBRM1MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140249024-A1 Pesticidal Methods Using Substituted 3-pyridyl Thiazole Compounds and Derivatives for Combating Animal Pests II BASF SE (DE) 2014-09-04 US disclosed
US-20140249024-A1 Pesticidal Methods Using Substituted 3-pyridyl Thiazole Compounds and Derivatives for Combating Animal Pests II BASF SE (DE) 2014-09-04 US disclosed
US-20140249024-A1 Pesticidal Methods Using Substituted 3-pyridyl Thiazole Compounds and Derivatives for Combating Animal Pests II BASF SE (DE) 2014-09-04 US disclosed
EP-2731426-A2 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS II BASF SE (DE) 2014-05-21 EP disclosed
WO-2013010947-A2 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS II BASF SE (DE) 2013-01-24 WO disclosed
WO-2013010947-A2 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS II BASF SE (DE) 2013-01-24 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 (1 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-20140249024-A1 Pesticidal Methods Using Substituted 3-pyridyl Thiazole Compounds and Derivatives for Combating Animal Pests II PTMS, PNPO, THOP1 ALOX5 1099/4885RAB9A 2297/4885NPC1 3308/4885

“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.