SCHEMBL8137394

SCHEMBL8137394

COCOc1cccc(F)c1C(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 6/20 0.49
EGFR P00533 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.43
TTR P02766 1/20 0.43
RXRA P19793 3/20 0.43
PTPN1 P18031 1/20 0.42
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
LPAR1 Q92633 1/20 0.40
LPAR5 Q9H1C0 1/20 0.40
RXRB P28702 2/20 0.40
FOLH1 Q04609 1/20 0.40
RXRG P48443 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL8122012 0.88 EGFR (0.45) EGFRPTPN1LMNAMAPK1HTT
SCHEMBL22394651 0.86 RORC (0.45) RORCMRGPRX4TTRRXRALMNA
SCHEMBL8132840 0.83 EGFR (0.46) EGFRMRGPRX4RXRALMNAMAPK1
SCHEMBL8131613 0.82 EGFR (0.48) RORCEGFRMRGPRX4RXRALMNA
SCHEMBL4630412 0.81 LMNA (0.48) EGFRMRGPRX4RXRALMNAMAPK1
SCHEMBL8136877 0.80 EGFR (0.46) EGFRRXRALMNAMAPK1HTT
SCHEMBL3149772 0.80 CA12 (0.44) PTPN1LMNARAB9AMAPTCA12
SCHEMBL8133460 0.80 EGFR (0.45) EGFRMRGPRX4RXRAPTPN1LMNA
SCHEMBL8131781 0.78 EGFR (0.44) EGFRMRGPRX4RXRALMNAMAPK1
SCHEMBL8128766 0.76 EGFR (0.43) EGFRRXRALMNAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663393-B1 3-Amino/hydroxy-4- 4-benzoylphenylcarboxylamino/oxy -azepanes and their homologies as protein kinase inhibitors HOFFMANN LA ROCHE (CH) 2000-07-05 EP disclosed
US-5914406-A ENZYME INHIBITOR; USEFUL FOR TREATMENT OF INFLAMMATORY SKIN DISORDERS AND ALOPECIA HOFFMAN-LA ROCHE INC. (US) 1999-06-22 US disclosed
US-5750706-A TREATMENT OF INFLAMMATORY SKIN DISORDERS AND ALOPECIA HOFFMANN-LA ROCHE INC. (US) 1998-05-12 US disclosed
US-5583222-A ANTIINFLAMMATORY AGENTS FOR TREATMENT OF SKIN DISORDERS HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US disclosed
EP-0663393-A1 Novel 3-amino/hydroxy-4- 4-benzoylphenylcarboxylamino/oxy -azepanes and their homologies as protein kinase inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1995-07-19 EP disclosed