SCHEMBL5010442

SCHEMBL5010442

COC(=O)c1cc(NC(=O)c2cc(F)c(F)cc2Cl)[nH]n1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
MAPT P10636 2/20 0.49
POLB P06746 2/20 0.46
APEX1 P27695 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.44
RECQL P46063 1/20 0.44
GAA P10253 1/20 0.43
PYGL P06737 3/20 0.42
CYP2C19 P33261 1/20 0.42
HPGD P15428 2/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALPL P05186 1/20 0.41

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
SCHEMBL3822773 0.88 HPGD (0.46) NPC1RAB9AMAPTPOLBAPEX1
SCHEMBL3822963 0.85 PYGL (0.50) NPC1RAB9AMAPTPOLBAPEX1
SCHEMBL14587655 0.83 NPC1 (0.47) NPC1RAB9AMAPTHTTRECQL
SCHEMBL14301501 0.82 NPC1 (0.41) NPC1RAB9AMAPTPOLBAPEX1
SCHEMBL14587643 0.82 PPARG (0.44) NPC1RAB9AMAPTHTTRECQL
SCHEMBL5009816 0.82 HTT (0.43) NPC1RAB9AMAPTPOLBAPEX1
SCHEMBL14587728 0.81 MAPT (0.54) NPC1RAB9AMAPTPOLBHTT
SCHEMBL14587611 0.81 HTT (0.42) NPC1RAB9AMAPTPOLBAPEX1
SCHEMBL5013495 0.81 PYGL (0.44) NPC1RAB9AMAPTPOLBAPEX1
SCHEMBL5013595 0.81 HTT (0.43) NPC1RAB9AMAPTPOLBAPEX1

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
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 NPC1 2838/4885RAB9A 2748/4885MAPT 4621/4885

“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.