SCHEMBL9749512

SCHEMBL9749512

COc1c(Cc2ccccc2)cc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.43
CNR2 P34972 2/20 0.42
GPR55 Q9Y2T6 1/20 0.42
MPL P40238 2/20 0.41
SUMO2 P61956 1/20 0.39
SUMO1 P63165 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP3 Q9H4L4 1/20 0.39
SENP2 Q9HC62 1/20 0.39
SENP1 Q9P0U3 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR1 P21554 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
SCHEMBL9748451 0.86 GPR55 (0.42) SLC2A1CNR2GPR55ALDH1A1CNR1
SCHEMBL9750351 0.86 CNR2 (0.42) SLC2A1CNR2GPR55ALDH1A1
SCHEMBL9748849 0.77 PTPN1 (0.47) CNR2GPR55CNR1
SCHEMBL9749291 0.75 CNR2 (0.43) CNR2GPR55ALDH1A1CNR1
SCHEMBL9141423 0.75 KMT2A (0.60) MPLALDH1A1LMNAMAPTKMT2A
SCHEMBL9749576 0.75 CNR2 (0.44) CNR2GPR55ALDH1A1CNR1
SCHEMBL9749737 0.75 GPR55 (0.47) CNR2GPR55ALDH1A1
SCHEMBL11164122 0.74 TTR (0.43)
SCHEMBL48093 0.73 MAPT (0.41) SLC2A1MPLSUMO2SUMO1SENP7
SCHEMBL11239311 0.72 TTR (0.49) LMNA

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 7 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
EP-0201071-A2 2-Substituted-1-naphthols as 5-lipoxygenase inhibitors THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1986-11-12 EP disclosed