SCHEMBL7735239

SCHEMBL7735239

O=C(NC(CO)CC(Cc1ccccc1)C(=O)NO)c1ccc(-c2cc3ccccc3o2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADCY6 O43306 3/20 0.47
ADCY3 O60266 3/20 0.47
ADCY9 O60503 3/20 0.47
ADCY5 O95622 3/20 0.47
ADCY8 P40145 3/20 0.47
GCGR P47871 3/20 0.47
ADCY7 P51828 3/20 0.47
ADCY2 Q08462 3/20 0.47
ADCY1 Q08828 3/20 0.47
ADCY4 Q8NFM4 3/20 0.47
ROCK2 O75116 1/20 0.46
RPS6KA5 O75582 1/20 0.46
RPS6KA4 O75676 1/20 0.46
PRKACA P17612 1/20 0.46
MAPK1 P28482 1/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
IRAK1 P51617 1/20 0.46
PRKX P51817 1/20 0.46
ROCK1 Q13464 1/20 0.46

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
SCHEMBL7735240 1.00 ADCY6 (0.47) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7740356 0.92 ROCK2 (0.48) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7740353 0.92 ROCK2 (0.48) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7734703 0.86 ADCY6 (0.44) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7734704 0.86 ADCY6 (0.44) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7741092 0.86 ADCY6 (0.44) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7741090 0.84 ADCY6 (0.46) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7741008 0.82 ADCY6 (0.61) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7734820 0.80 ADCY6 (0.42) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL7734814 0.80 ADCY6 (0.42) ADCY6ADCY3ADCY9ADCY5ADCY8

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
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US claimed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP claimed
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed