SCHEMBL3407702

SCHEMBL3407702

CC(C)CN(C(=O)Nc1ccc(C(F)(F)F)cc1)c1ccc2nc(S)sc2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.39
MTOR P42345 1/20 0.38
MAPT P10636 1/20 0.36
AHR P35869 1/20 0.36
CSNK1D P48730 1/20 0.36
FPR2 P25090 1/20 0.35
EPHX2 P34913 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
MMP3 P08254 1/20 0.34
MAPK14 Q16539 1/20 0.34

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
SCHEMBL3401950 0.89 MCHR1 (0.41) MCHR1MTORAHRCSNK1DEPHX2
SCHEMBL3403300 0.88 MAPT (0.35) MAPTEPHX2LMNA
SCHEMBL3404213 0.86 MAPT (0.35) MAPTEPHX2MEN1KMT2A
SCHEMBL3411100 0.85 MCHR1 (0.41) MCHR1MTORMAPTAHRCSNK1D
SCHEMBL3406303 0.85 MLYCD (0.39) MCHR1MMP3
SCHEMBL3403386 0.85 CSNK1D (0.33) MCHR1MAPTCSNK1DEPHX2MEN1
SCHEMBL3406810 0.85 F2R (0.38) MAPTEPHX2MEN1KMT2ALMNA
SCHEMBL3407910 0.84 MTOR (0.41) MCHR1MTORMAPTAHRCSNK1D
SCHEMBL3405074 0.84 CA1 (0.42) MAPTLMNA
SCHEMBL3410353 0.83 KMT2A (0.35) MAPTEPHX2MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370260-B1 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2010-11-24 EP claimed
US-20040092503-A1 Azoles as malonyl-coa decarboxylase inhibitors useful as metabolic modulators CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2004-05-13 US claimed
EP-1370260-A2 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-12-17 EP claimed
WO-2002066035-A2 AZOLES AS MALONYL-COA DECARBOXYLASE INHIBITORS USEFUL AS METABOLIC MODULATORS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-08-29 WO claimed

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-20040092503-A1 Azoles as malonyl-coa decarboxylase inhibitors useful as metabolic modulators ME1, ME3, ME2 MCHR1 858/4885MTOR 1015/4885MAPT 3030/4885

“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.