SCHEMBL9749183

SCHEMBL9749183

CC(=O)c1cc(Cc2ccccc2)c(O)c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.54
PTPN1 P18031 3/20 0.53
PTPN2 P17706 1/20 0.53
PTPN6 P29350 1/20 0.53
HMGB1 P09429 1/20 0.51
CXCL12 P48061 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
NSD2 O96028 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
MCL1 Q07820 1/20 0.50

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
SCHEMBL9748865 0.87 PTPN1 (0.64) BCL2PTPN1PTPN2PTPN6HMGB1
SCHEMBL9749162 0.84 PTPN1 (0.53) BCL2PTPN1PTPN2PTPN6HMGB1
SCHEMBL9750299 0.84 PTPN1 (0.53) BCL2PTPN1PTPN2PTPN6HMGB1
SCHEMBL9750199 0.81 PDE3B (0.56) KDM4E
SCHEMBL9515371 0.80 MAPT (0.44) BCL2KDM4EPOLBMAPT
SCHEMBL9618995 0.78 HMGB1 (0.84) PTPN1PTPN2PTPN6HMGB1CXCL12
SCHEMBL3590445 0.76 PAX8 (0.56) BCL2HMGB1CXCL12KDM4E
SCHEMBL9748744 0.76 LMNA (0.48) BCL2PTPN1PTPN2PTPN6HMGB1
SCHEMBL8772360 0.76 HMGB1 (0.56) BCL2PTPN1PTPN2PTPN6HMGB1
SCHEMBL11070082 0.76 BCL2 (0.64) BCL2

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