SCHEMBL14587761

SCHEMBL14587761

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPT P10636 1/20 0.38
PYGL P06737 4/20 0.37
CYP3A4 P08684 2/20 0.35
CYP2C19 P33261 1/20 0.35
LIMK1 P53667 2/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HCAR2 Q8TDS4 1/20 0.34
NTRK1 P04629 1/20 0.33

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
SCHEMBL14587760 0.93 HTT (0.39) HTTRECQLNPC1RAB9AMAPT
SCHEMBL14587759 0.92 HTT (0.40) HTTRECQLNPC1RAB9AMAPT
SCHEMBL5010820 0.90 HTT (0.43) HTTRECQLNPC1RAB9AMAPT
SCHEMBL14297710 0.84 CYP2C19 (0.41) HTTRECQLNPC1RAB9AMAPT
SCHEMBL14587752 0.84 HTT (0.41) HTTRECQLNPC1RAB9AMAPT
SCHEMBL5010646 0.83 CYP2C19 (0.41) HTTRECQLNPC1RAB9AMAPT
SCHEMBL14587754 0.83 NPC1 (0.39) HTTRECQLNPC1RAB9AMAPT
SCHEMBL5009816 0.83 HTT (0.43) HTTRECQLNPC1RAB9AMAPT
SCHEMBL5010563 0.83 HTT (0.41) HTTRECQLNPC1RAB9AMAPT
SCHEMBL14587645 0.82 NPC1 (0.42) HTTRECQLNPC1RAB9APYGL

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 HTT 4237/4885RECQL 766/4885NPC1 2838/4885

“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.