SCHEMBL13760071

SCHEMBL13760071

Cc1ccc(C)c(-n2nc(C)cc2Nc2nc(C)ccc2C(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 6/20 0.42
LMNA P02545 5/20 0.42
HTT P42858 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NTRK1 P04629 3/20 0.41
GFER P55789 2/20 0.40
GAA P10253 1/20 0.40
ACLY P53396 1/20 0.39
TSHR P16473 1/20 0.39
KCNJ6 P48051 1/20 0.39
KCNJ5 P48544 1/20 0.39
KCNJ3 P48549 1/20 0.39
ALOX15 P16050 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ADORA2A P29274 1/20 0.38
SORT1 Q99523 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 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
SCHEMBL3883353 0.89 MAPK14 (0.48) ACLY
SCHEMBL3863281 0.87 MAPT (0.44) SMN1; SMN2MAPTLMNAHTTL3MBTL1
SCHEMBL3973832 0.87 ACLY (0.35) SMN1; SMN2MAPTLMNAHTTL3MBTL1
SCHEMBL3979001 0.85 MAPT (0.39) SMN1; SMN2MAPTLMNAHTTNPSR1
SCHEMBL3974140 0.81 MAPK14 (0.46)
SCHEMBL3976330 0.80 MAPK14 (0.46) NTRK1ACLY
SCHEMBL1810794 0.80 GFER (0.44) SMN1; SMN2MAPTLMNAHTTL3MBTL1
SCHEMBL3975282 0.79 MAPK14 (0.42) ACLY
SCHEMBL3980494 0.78 MAPK14 (0.59) MAPTLMNAHTTL3MBTL1NTRK1
SCHEMBL4251798 0.78 MAPT (0.41) SMN1; SMN2MAPTLMNANTRK1ACLY

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-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

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-20090209451-A1 HETEROARYLAMINOPYRAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF DIABETES GPR119, GOT2, IAPP SMN1; SMN2 4413/4885MAPT 3713/4885LMNA 3423/4885

“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.