SCHEMBL3972877

SCHEMBL3972877

Cc1ccc(C(=O)O)c(Nc2cc(-c3ccccc3)nn2-c2c(C)cccc2C)n1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.41
GRM5 P41594 5/20 0.41
LDHA P00338 3/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 3/20 0.39
SOAT2 O75908 2/20 0.39
SOAT1 P35610 2/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NTRK1 P04629 1/20 0.38

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
SCHEMBL3974518 0.92 GRM5 (0.40) MAPTTP53POLBGRM5LDHA
SCHEMBL3974125 0.89 ALDH1A1 (0.46) MAPTTP53POLBGRM5LDHA
SCHEMBL3977196 0.85 ADORA1 (0.40) MAPTPOLBGRM5L3MBTL1NTRK1
SCHEMBL3863281 0.85 MAPT (0.44) MAPTTP53POLBGRM5ALDH1A1
SCHEMBL3973035 0.83 MAPK14 (0.44) GAA
SCHEMBL3974168 0.83 ADORA1 (0.47) MAPTTP53POLBGRM5ALDH1A1
SCHEMBL3980188 0.82 MAPK13 (0.43) MAPT
SCHEMBL4251798 0.78 MAPT (0.41) MAPTPOLBGRM5LDHAALDH1A1
SCHEMBL3973641 0.77 MAPT (0.40) MAPTPOLBGRM5ALDH1A1LMNA
SCHEMBL3979001 0.76 MAPT (0.39) MAPTTP53POLBGRM5LDHA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-20 US disclosed
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-20 US disclosed
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-20 US disclosed
US-7517878-B2 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARAMCEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-7517878-B2 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARAMCEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-7517878-B2 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARAMCEUTICALS CORPORATION (US) 2009-04-14 US disclosed
US-20050192294-A1 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2005-09-01 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 (2 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-20050192294-A1 Heteroarylaminopyrazole derivatives useful for the treatment of diabetes GPR119, GOT2, IAPP MAPT 3713/4885TP53 2635/4885POLB 3716/4885
US-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES GPR119, GOT2, IAPP MAPT 3713/4885TP53 2635/4885POLB 3716/4885

“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.