SCHEMBL14636639

SCHEMBL14636639

CN(C)C(=O)c1sc(-c2cccnc2)nc1C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.52
CYP3A4 P08684 4/20 0.52
CYP2C19 P33261 3/20 0.52
LMNA P02545 1/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
MAPT P10636 2/20 0.52
CDC7 O00311 3/20 0.49
DBF4 Q9UBU7 3/20 0.49
HSD17B10 Q99714 5/20 0.46
TSHR P16473 2/20 0.46
KDM4E B2RXH2 2/20 0.46
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CSNK1D P48730 1/20 0.43
CSNK1E P49674 1/20 0.43
ALOX5 P09917 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL14635631 0.89 TRPM8 (0.50) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL14636748 0.86 CYP3A4 (0.55) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL14637387 0.85 MEN1 (0.47) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL290490 0.85 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL14654129 0.83 CYP1A2 (0.71) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL14654292 0.83 NPC1 (0.54) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL15991054 0.83 NPC1 (0.54) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL10974241 0.82 CYP1A2 (0.71) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL11390772 0.82 CYP1A2 (0.56) CYP1A2CYP3A4CYP2C19LMNAMEN1
SCHEMBL14652371 0.81 CYP1A2 (0.55) CYP1A2CYP3A4CYP2C19LMNAMEN1

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-20140296064-A1 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I BASF SE (DE) 2014-10-02 US disclosed
US-20140296064-A1 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I BASF SE (DE) 2014-10-02 US disclosed
US-20140296064-A1 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I BASF SE (DE) 2014-10-02 US disclosed
EP-2731427-A2 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I BASF SE (DE) 2014-05-21 EP disclosed
WO-2013010946-A2 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I BASF SE (DE) 2013-01-24 WO disclosed
WO-2013010946-A2 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I 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-20140296064-A1 PESTICIDAL METHODS USING SUBSTITUTED 3-PYRIDYL THIAZOLE COMPOUNDS AND DERIVATIVES FOR COMBATING ANIMAL PESTS I PTMS, THOP1, TH CYP1A2 329/4885CYP3A4 778/4885CYP2C19 1939/4885

“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.