SCHEMBL9534719

SCHEMBL9534719

COc1ccc2c(c1)c(S(C)(=O)=O)c(C(=O)Nc1nnn[nH]1)n2-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
EDNRA P25101 3/20 0.41
HTR6 P50406 7/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK8 P45983 5/20 0.37

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
SCHEMBL9536287 0.87 KDM4E (0.47) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL9535102 0.84 KDM4E (0.44) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL6438548 0.83 KDM4E (0.43) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL9535836 0.83 MEN1 (0.44) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL9536999 0.83 KDM4E (0.43) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL10760718 0.82 MEN1 (0.43) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL10760702 0.82 MEN1 (0.43) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL9536074 0.82 KDM4E (0.42) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL9535709 0.82 KDM4E (0.42) KDM4EMAPTHTTEDNRAMEN1
SCHEMBL9537498 0.81 KDM4E (0.44) KDM4EMAPTHTTEDNRAMEN1

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