SCHEMBL14587736

SCHEMBL14587736

COc1ccc(CNC(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)c(OC)n1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.42
HPGD P15428 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
HTT P42858 2/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 6/20 0.41
MAPT P10636 1/20 0.41
PTGES O14684 2/20 0.39
PYGL P06737 1/20 0.39
NTRK1 P04629 3/20 0.38
RECQL P46063 1/20 0.37
MAPK1 P28482 1/20 0.36
PPARG P37231 1/20 0.35

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
SCHEMBL14301500 0.91 NTRK1 (0.41) RAB9AHTTNPC1MAPTPTGES
SCHEMBL14587730 0.86 MAPK8 (0.46) RAB9AALDH1A1NPC1MAPTPTGES
SCHEMBL14587613 0.83 NTRK1 (0.54) RAB9ASMN1; SMN2NPC1MAPTNTRK1
SCHEMBL5008451 0.83 ALDH1A1 (0.49) RAB9AHPGDTSHRHTTALDH1A1
SCHEMBL5012144 0.83 PPARG (0.52) RAB9AHPGDSMN1; SMN2HTTALDH1A1
SCHEMBL14587634 0.81 NTRK1 (0.43) RAB9AHTTNPC1MAPTPTGES
SCHEMBL5010409 0.81 GSK3B (0.46) RAB9AHPGDSMN1; SMN2ALDH1A1NPC1
SCHEMBL5008275 0.81 MAPT (0.48) RAB9AHPGDHTTALDH1A1NPC1
SCHEMBL14297692 0.80 EZH2 (0.43) RAB9AHTTNPC1MAPTPYGL
SCHEMBL5013605 0.80 NPC1 (0.45) RAB9AHPGDSMN1; SMN2ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL RAB9A 2748/4885HPGD 3765/4885SMN1; SMN2 4705/4885

“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.