SCHEMBL5010652

SCHEMBL5010652

CNC(=O)c1ccc(N(C)C(=O)c2cc(NC(=O)c3cc(F)c(Cl)cc3Cl)[nH]n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PI4KA P42356 1/20 0.39
PIK3CG P48736 1/20 0.39
PIK3C3 Q8NEB9 1/20 0.39
ALPL P05186 2/20 0.37
HSP90AA1 P07900 1/20 0.37
CYP2C19 P33261 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
GPR27 Q9NS67 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MCHR1 Q99705 1/20 0.33
NTRK1 P04629 1/20 0.33
MET P08581 1/20 0.33
F10 P00742 1/20 0.33
MAPT P10636 1/20 0.33
RORC P51449 1/20 0.32
PRSS12 P56730 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) ALPLHSP90AA1CYP2C19NPC1RAB9A
SCHEMBL14587791 0.90 RORC (0.40) ALPLCYP2C19NPC1RAB9AGPR27
SCHEMBL14297710 0.86 CYP2C19 (0.41) CYP2C19NPC1RAB9AMAPTPRSS12
SCHEMBL5010646 0.85 CYP2C19 (0.41) CYP2C19NPC1RAB9AMAPTPRSS12
SCHEMBL14587797 0.85 CYP2C19 (0.43) CYP2C19NPC1RAB9AMAPT
SCHEMBL14301501 0.85 NPC1 (0.41) CYP2C19NPC1RAB9ASMN1; SMN2MCHR1
SCHEMBL5010648 0.85 CYP2C19 (0.42) CYP2C19NPC1RAB9AMAPT
SCHEMBL14587804 0.84 CYP2C19 (0.39) CYP2C19NPC1RAB9AF10MAPT
SCHEMBL5009797 0.83 NPC1 (0.44) CYP2C19NPC1RAB9ANTRK1MAPT
SCHEMBL14587798 0.81 CYP2C19 (0.40) CYP2C19NPC1RAB9AMAPT

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
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP claimed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP disclosed
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
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 PIK3CD 1690/4885PIK3CB 1636/4885PI4KA 576/4885

“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.