SCHEMBL5010633

SCHEMBL5010633

CCc1ccccc1-n1nc(-c2ccc(F)cc2)cc1Nc1ccccc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 1/20 0.46
MAPT P10636 4/20 0.44
GRM5 P41594 2/20 0.43
ADORA1 P30542 3/20 0.43
GFER P55789 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
RECQL P46063 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
RAB9A P51151 1/20 0.42
CDK2 P24941 2/20 0.40
CDC7 O00311 1/20 0.40
DAPK3 O43293 1/20 0.40
PAK4 O96013 1/20 0.40
PIM1 P11309 1/20 0.40
FLT3 P36888 1/20 0.40
GSK3B P49841 1/20 0.40
CDK9 P50750 1/20 0.40

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
SCHEMBL27637060 0.92 GRM5 (0.42) MAPTGRM5ADORA1GFERTDP1
SCHEMBL5008323 0.89 ADORA1 (0.54) MAPTGRM5ADORA1GFERPOLB
SCHEMBL28754581 0.85 GRM5 (0.41) MAPTGRM5ADORA1TDP1L3MBTL1
SCHEMBL27637162 0.84 MAPT (0.47) CLCN2MAPTGRM5GFERTDP1
SCHEMBL27617987 0.83 MAPT (0.42) CLCN2MAPTGRM5ADORA1GFER
SCHEMBL5012064 0.83 ADORA1 (0.53) MAPTADORA1TDP1L3MBTL1POLB
SCHEMBL5008441 0.82 MAPT (0.47) MAPTGRM5ADORA1GFERTDP1
SCHEMBL27637093 0.82 MAPT (0.43) MAPTGRM5GFERTDP1L3MBTL1
SCHEMBL27637094 0.82 GRM5 (0.42) MAPTGRM5TDP1L3MBTL1RAB9A
SCHEMBL5007784 0.82 ADORA1 (0.51) CLCN2MAPTGRM5ADORA1POLB

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
CN-100448869-C Anilinopyrazole derivatives for the treatment of diabetes BAYER PHARMACEUTICALS CORP (US) 2009-01-07 CN disclosed
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
CN-1717401-A Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORP (US) 2006-01-04 CN 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-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 CLCN2 1799/4885MAPT 2420/4885GRM5 2906/4885

“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.