SCHEMBL9536815

SCHEMBL9536815

COC(=O)c1c(OC(C)C)c2ccccc2n1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 3/20 0.51
NR4A2 P43354 1/20 0.46
KDM4E B2RXH2 3/20 0.44
PKM P14618 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
CYP2C19 P33261 1/20 0.44
PABPC1 P11940 1/20 0.43
EIF4H Q15056 1/20 0.43
PPARG P37231 5/20 0.43
MAPK9 P45984 1/20 0.42
PLA2G2A P14555 1/20 0.41
LMNA P02545 1/20 0.41
FOLH1 Q04609 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
SCHEMBL9535567 0.90 PPARG (0.48) MAPK8PKMHPGDHSD17B10MAPT
SCHEMBL10756621 0.88 PPARG (0.53) MAPK8KDM4EPKMPPARGLMNA
SCHEMBL9538497 0.86 MAPK8 (0.55) MAPK8NR4A2KDM4EPKMHPGD
SCHEMBL9534704 0.86 KDM4E (0.53) MAPK8KDM4EPKMHPGDHSD17B10
SCHEMBL9538268 0.86 MAPK8 (0.52) MAPK8KDM4EPKMHPGDHSD17B10
SCHEMBL10464433 0.82 MAPK8 (0.57) MAPK8NR4A2KDM4EPKMHPGD
SCHEMBL10758409 0.81 PPARG (0.60) KDM4EMAPTPPARGLMNAFOLH1
SCHEMBL10761739 0.80 MAPK8 (0.52) MAPK8NR4A2KDM4EPKMHPGD
SCHEMBL10656000 0.80 MAPK8 (0.52) MAPK8NR4A2KDM4EPKMHPGD
SCHEMBL27286578 0.80 MAPK8 (0.55) MAPK8NR4A2KDM4EPKMHPGD

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 4 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 disclosed
CN-1005974-B Process for preparing acid indole compounds 沃纳·兰伯特公司 1989-12-06 CN 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