SCHEMBL5013495

SCHEMBL5013495

CNC(N)=O.O=C(O)c1cc(NC(=O)c2cc(F)c(F)cc2Cl)[nH]n1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PYGL P06737 4/20 0.44
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
MAPT P10636 1/20 0.40
CYP2C19 P33261 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 2/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3822963 0.92 PYGL (0.50) PYGLNPC1RAB9APOLBAPEX1
SCHEMBL5013483 0.85 GPR27 (0.44) PYGLNPC1RAB9APOLBAPEX1
Imidazole SCHEMBL3820589 0.81 PYGL (0.42) PYGLNPC1RAB9APOLBAPEX1
SCHEMBL5010442 0.81 NPC1 (0.49) PYGLNPC1RAB9APOLBAPEX1
SCHEMBL3825349 0.80 HCAR2 (0.44) NPC1RAB9A
SCHEMBL5010377 0.80 CYTH3 (0.38) PYGLNPC1RAB9A
SCHEMBL5013494 0.79 NTRK1 (0.45) PYGLNPC1RAB9APOLBAPEX1
SCHEMBL5012183 0.79 NPC1 (0.55) NPC1RAB9AMAPTCYP2C19KMT2A
SCHEMBL5009899 0.77 STING1 (0.41) PYGL
SCHEMBL3822773 0.77 HPGD (0.46) NPC1RAB9APOLBAPEX1MAPT

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-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

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 PYGL 1/4885NPC1 2838/4885RAB9A 2748/4885

“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.