SCHEMBL8428338

SCHEMBL8428338

CCC1=C(Cc2nnn[nH]2)c2ccccc2C1=Cc1ccc(Cl)cc1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.36
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LRRK2 Q5S007 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL8428468 0.84 MEN1 (0.39) RXRAMEN1KMT2ALRRK2
SCHEMBL8430717 0.76 RXRA (0.39) RXRAMEN1KMT2AL3MBTL1
SCHEMBL8430782 0.74 RXRA (0.38) RXRAMEN1KMT2A
SCHEMBL25305589 0.73 RXRA (0.46) RXRA
SCHEMBL8428613 0.73 RXRA (0.37) RXRAMEN1KMT2ALRRK2
SCHEMBL8428373 0.72 RXRA (0.39) RXRAMEN1KMT2A
SCHEMBL8431725 0.72 RXRA (0.36) RXRAMEN1KMT2AL3MBTL1
SCHEMBL8428336 0.72 GCGR (0.31)
SCHEMBL8428278 0.70 AMY1A (0.42) RXRAMEN1KMT2A
SCHEMBL18245005 0.69 RXRA (0.67) RXRAMEN1KMT2A

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