SCHEMBL9323969

SCHEMBL9323969

Cn1nc(CC(=O)O)c2cc(Cl)ccc21

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 6/20 0.51
MAPK8 P45983 7/20 0.49
MAPK9 P45984 3/20 0.47
MAPK10 P53779 3/20 0.47
KDM4C Q9H3R0 1/20 0.46
KMO O15229 1/20 0.46
PTGDR2 Q9Y5Y4 4/20 0.45
NTRK1 P04629 1/20 0.43

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
SCHEMBL12984735 0.88 KMO (0.52) AKR1B1MAPK8MAPK9MAPK10KDM4C
SCHEMBL3247322 0.83 AKR1B1 (0.57) AKR1B1MAPK8KMOPTGDR2
SCHEMBL16881243 0.80 MAPK8 (0.49) MAPK8MAPK9MAPK10KDM4C
SCHEMBL13106420 0.80 MAPK8 (0.56) MAPK8MAPK9MAPK10KDM4C
SCHEMBL15898846 0.80 GABRA1 (0.48) MAPK8MAPK9MAPK10KDM4C
SCHEMBL8415002 0.78 MAPT (0.54) AKR1B1PTGDR2
Fumaric Acid SCHEMBL8138712 0.78 MAPK8 (0.53) MAPK8MAPK9MAPK10KDM4C
SCHEMBL10253820 0.77 KDM4C (0.52) MAPK8MAPK9MAPK10KDM4CKMO
Fumaric Acid SCHEMBL8138713 0.76 MAPK8 (0.40) MAPK8MAPK9MAPK10KDM4CKMO
Fumaric Acid SCHEMBL8138709 0.76 MAPK8 (0.40) MAPK8MAPK9MAPK10KDM4CKMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5330997-A 1H-indazole-3-acetic acids as aldose reductase inhibitors PFIZER INC. (US) 1994-07-19 US disclosed
US-5236945-A 1H-indazole-3-acetic acids as aldose reductase inhibitors PFIZER INC. (US) 1993-08-17 US disclosed
EP-0325375-B1 1H-INDAZOLE-3-ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1992-08-12 EP disclosed
WO-1989006651-A1 1H-INDAZOLE-3-ACETIC ACIDS AS ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1989-07-27 WO disclosed
EP-0325375-A1 1H-indazole-3-acetic acids as aldose reductase inhibitors PFIZER INC. (US) 1989-07-26 EP disclosed
US-4008070-A ALKYL 5-HALO-1H-INDAZOLE-3-ACETATE NISSAN CHEMICAL INDUSTRIES CO., LTD. (JA) 1977-02-15 US disclosed