SCHEMBL10758409

SCHEMBL10758409

COc1ccc(-n2c(C(=O)O)c(OC(C)C)c3ccccc32)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.60
EDNRA P25101 4/20 0.53
PPARA Q07869 3/20 0.51
MAPT P10636 3/20 0.45
LMNA P02545 1/20 0.45
KDM4E B2RXH2 2/20 0.44
PTPN1 P18031 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
FOLH1 Q04609 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL10756621 0.90 PPARG (0.53) PPARGEDNRAPPARALMNAKDM4E
SCHEMBL9535567 0.89 PPARG (0.48) PPARGEDNRAPPARAMAPTLMNA
SCHEMBL9144495 0.87 KDM4E (0.58) PPARGEDNRAPPARAMAPTKDM4E
SCHEMBL9536815 0.81 MAPK8 (0.51) PPARGPPARAMAPTLMNAKDM4E
SCHEMBL11038273 0.81 EDNRA (0.57) PPARGEDNRAPPARAMAPTLMNA
SCHEMBL10412007 0.80 PPARG (0.55) PPARGEDNRAPPARALMNAKDM4E
SCHEMBL7111400 0.80 EDNRA (0.56) PPARGEDNRAPPARAMAPTLMNA
Hydrochloric Acid SCHEMBL10462662 0.79 PPARG (0.54) PPARGEDNRAPPARALMNAKDM4E
SCHEMBL9535097 0.78 PPARG (0.40) PPARGEDNRAMAPTLMNA
SCHEMBL9141602 0.78 KDM4E (0.53) PPARGEDNRAMAPTKDM4EHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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