SCHEMBL9535154

SCHEMBL9535154

COc1ccc2c(c1)c(SC(C)C)c(C(=O)Nc1nnn[nH]1)n2Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 19/20 0.46
PLA2G1B P04054 1/20 0.44
EDNRB P24530 1/20 0.43
EDNRA P25101 1/20 0.43

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
SCHEMBL9536074 0.85 KDM4E (0.42) EDNRA
SCHEMBL9538437 0.82 EDNRB (0.60) PLA2G2APLA2G1BEDNRBEDNRA
SCHEMBL9536370 0.79 CCR2 (0.50) EDNRBEDNRA
SCHEMBL9535102 0.76 KDM4E (0.44) PLA2G2AEDNRA
SCHEMBL9537498 0.75 KDM4E (0.44) PLA2G2AEDNRBEDNRA
SCHEMBL9536999 0.74 KDM4E (0.43) EDNRBEDNRA
SCHEMBL9246108 0.74 MPO (0.48)
SCHEMBL6438548 0.72 KDM4E (0.43) EDNRA
SCHEMBL9535836 0.72 MEN1 (0.44) EDNRA
SCHEMBL9536287 0.72 KDM4E (0.47) EDNRA

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-0186367-B1 ACIDIC INDOLE COMPOUNDS AND THEIR USE AS ANTIALLERGY AGENTS WARNER-LAMBERT COMPANY (US) 1993-03-03 EP claimed
US-4675332-A Acidic tetrazolyl substituted indole compounds and their use as antiallergy agents WARNER-LAMBERT COMPANY (US) 1987-06-23 US claimed
EP-0186367-A2 Acidic indole compounds and their use as antiallergy agents WARNER-LAMBERT COMPANY (US) 1986-07-02 EP claimed
EP-0186367-B1 ACIDIC INDOLE COMPOUNDS AND THEIR USE AS ANTIALLERGY AGENTS WARNER-LAMBERT COMPANY (US) 1993-03-03 EP disclosed
US-4675332-A Acidic tetrazolyl substituted indole compounds and their use as antiallergy agents WARNER-LAMBERT COMPANY (US) 1987-06-23 US disclosed
EP-0186367-A2 Acidic indole compounds and their use as antiallergy agents WARNER-LAMBERT COMPANY (US) 1986-07-02 EP disclosed