SCHEMBL14587791

SCHEMBL14587791

CN(C(=O)c1cc(NC(=O)c2cc(F)c(Cl)cc2Cl)[nH]n1)c1ccc(C(N)=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.40
CYP2C19 P33261 1/20 0.36
CHEK2 O96017 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
ALPL P05186 1/20 0.35
GPR27 Q9NS67 1/20 0.34
NTRK1 P04629 2/20 0.33
MAPT P10636 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CCNA1 P78396 1/20 0.33
HDAC6 Q9UBN7 1/20 0.32
BCAT2 O15382 1/20 0.32
PYGL P06737 2/20 0.32
STING1 Q86WV6 1/20 0.32
KMT2A Q03164 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
SCHEMBL14587795 0.91 KDM4E (0.40) CYP2C19NPC1RAB9AALPLGPR27
SCHEMBL5010652 0.90 PIK3CD (0.39) RORCCYP2C19NPC1RAB9AALPL
SCHEMBL14297710 0.86 CYP2C19 (0.41) CYP2C19NPC1RAB9AMAPTPYGL
SCHEMBL5010646 0.85 CYP2C19 (0.41) CYP2C19NPC1RAB9AMAPTPYGL
SCHEMBL5010648 0.85 CYP2C19 (0.42) CYP2C19NPC1RAB9AMAPTPYGL
SCHEMBL14301501 0.85 NPC1 (0.41) CYP2C19NPC1RAB9AMAPTPYGL
SCHEMBL14587804 0.84 CYP2C19 (0.39) CYP2C19NPC1RAB9AMAPTPYGL
SCHEMBL14587797 0.83 CYP2C19 (0.43) CYP2C19NPC1RAB9AMAPTPYGL
SCHEMBL5622267 0.83 RAB9A (0.40) RORCCYP2C19NPC1RAB9AALPL
SCHEMBL5009797 0.83 NPC1 (0.44) CYP2C19NPC1RAB9ANTRK1MAPT

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 RORC 2266/4885CYP2C19 517/4885CHEK2 2886/4885

“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.