SCHEMBL20933301

SCHEMBL20933301

CC1(C)c2ccccc2-c2c1ccc1c2Oc2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccccc6)cc5)n4)c3)cc2O1

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 1/20 0.31
USP2 O75604 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
ALOX15 P16050 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CLK4 Q9HAZ1 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL20934237 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20934243 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933413 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933304 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933291 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933303 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933972 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933298 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20934100 1.00 RARA (0.31) RARARARBRARGUSP2LMNA
SCHEMBL20933126 1.00 RARA (0.31) RARARARBRARGUSP2LMNA

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
WO-2019078461-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2019-04-25 WO disclosed