SCHEMBL14587693

SCHEMBL14587693

Cc1ccnc(CNC(=O)c2cc(NC(=O)c3cc(F)c(F)cc3Cl)[nH]n2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.44
PPARG P37231 2/20 0.42
NTRK1 P04629 7/20 0.42
WDR5 P61964 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SORT1 Q99523 1/20 0.40
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC40A1 Q9NP59 1/20 0.39
PTGES O14684 1/20 0.39

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
SCHEMBL14587735 0.88 NTRK1 (0.54) RAB9ANPC1PPARGNTRK1WDR5
SCHEMBL14587772 0.88 ALDH1A1 (0.43) RAB9ANPC1PPARGNTRK1ALDH1A1
SCHEMBL14587694 0.86 RAB9A (0.56) RAB9ANPC1HPGDPPARGNTRK1
SCHEMBL14587722 0.86 NTRK1 (0.54) RAB9ANPC1HPGDPPARGNTRK1
SCHEMBL14587681 0.84 NTRK1 (0.51) RAB9ANPC1PPARGNTRK1ALDH1A1
SCHEMBL5013431 0.84 NPC1 (0.49) RAB9ANPC1PPARG
SCHEMBL14301497 0.84 PPARG (0.44) RAB9ANPC1PPARGNTRK1ALDH1A1
SCHEMBL14587786 0.83 NPC1 (0.44) RAB9ANPC1PPARGNTRK1WDR5
SCHEMBL5010362 0.83 PPARG (0.50) RAB9ANPC1HPGDPPARGALDH1A1
SCHEMBL14587641 0.83 PPARG (0.41) PPARGNTRK1ALDH1A1HTTRECQL

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 RAB9A 2748/4885NPC1 2838/4885HPGD 3765/4885

“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.