SCHEMBL8430723

SCHEMBL8430723

COc1ccc2c(c1)C(CC#N)=C(C)C2=Cc1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.43
PPARG P37231 4/20 0.41
LCK P06239 2/20 0.39
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ABCG2 Q9UNQ0 2/20 0.36
PRKACA P17612 1/20 0.36
PRKACG P22612 1/20 0.36
PRKACB P22694 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL8428198 0.88 PPARG (0.50) RXRAPPARGLCKMEN1MAPT
SCHEMBL8432124 0.86 MAOB (0.45) RXRAPPARGLCKMEN1GAA
SCHEMBL8154649 0.86 RXRA (0.44) RXRAPPARGLCKMEN1GAA
SCHEMBL8154646 0.86 RXRA (0.44) RXRAPPARGLCKMEN1GAA
SCHEMBL8432071 0.85 PPARG (0.41) RXRAPPARGMEN1MAPTKMT2A
SCHEMBL8428246 0.85 RXRA (0.48) RXRAPPARGLCKMEN1MAPT
SCHEMBL8430314 0.83 PPARG (0.39) RXRAPPARGLCKMEN1MAPT
SCHEMBL8432058 0.83 PPARG (0.40) RXRAPPARGLCKMAPT
SCHEMBL8431908 0.82 LCK (0.38) RXRALCKMAPTABCG2PRKACA
SCHEMBL8432304 0.82 AR (0.40) PPARGMEN1MAPTKMT2AABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5965619-A ADMINISTERING AN INDENE DERIVATIVE OF GIVEN FORMULA, SUCH AS 1-(2,4,6-TRIMETHOXYBENZYLIDENE)-5-DIMETHYLAMINO-2-METHYL-3-INDENYL ACETIC ACID, TO TREAT PRECANCEROUS LESIONS SUCH AS COLONIC ADENOMATOUS POLYPS; SIDE EFFECT REDUCTION CELL PATHWAYS INC. (US) 1999-10-12 US disclosed