SCHEMBL9749291

SCHEMBL9749291

COc1c(Cc2ccccc2)cc(C(N)=O)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.43
CNR1 P21554 2/20 0.43
GPR55 Q9Y2T6 1/20 0.42
PLA2G10 O15496 1/20 0.41
PLA2G2A P14555 1/20 0.41
IKBKB O14920 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL9748849 0.89 PTPN1 (0.47) CNR2CNR1GPR55
SCHEMBL5595854 0.83 CNR2 (0.43) CNR2CNR1GPR55PLA2G10PLA2G2A
SCHEMBL9750299 0.80 PTPN1 (0.53)
SCHEMBL29072194 0.80 CNR1 (0.46) CNR2CNR1IKBKBALDH1A1
SCHEMBL16654871 0.80 CNR2 (0.45) CNR2CNR1GPR55PLA2G10PLA2G2A
SCHEMBL9750220 0.79 LMNA (0.44) CNR2CNR1ALDH1A1
SCHEMBL28286023 0.76 KDM4E (0.45) ALDH1A1
SCHEMBL27902640 0.75 AADAT (0.45) IKBKBALDH1A1
SCHEMBL9749512 0.75 SLC2A1 (0.43) CNR2CNR1GPR55ALDH1A1
SCHEMBL9750351 0.75 CNR2 (0.42) CNR2GPR55ALDH1A1

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
EP-0201071-B1 2-SUBSTITUTED-1-NAPHTHOLS AS 5-LIPOXYGENASE INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-03-04 EP disclosed
US-5026759-A Antiinflammatory agents respiratory system disorders DU PONT MERCK PHARMACEUTICAL (US) 1991-06-25 US disclosed
US-4985442-A ANTIINFLAMMATORY, LUNG DISEASES, PSORIASIS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-15 US disclosed
US-4985435-A TREATMENT OF INFLAMMATION, OBSTRUCTIVE LUNG DISEASES AND PSORIASIS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-15 US disclosed
US-4906636-A 2-Substituted-1-naphthols as 5-lipoxygenase inhibitors E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-06 US disclosed
US-4833164-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-05-23 US disclosed