SCHEMBL29314516

SCHEMBL29314516

CCCCCCc1cc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(C)cc4)cc3)cc2C)c(CCCCCC)cc1-c1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc(C)cc3)cc2)cc1C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.39
LTB4R2 Q9NPC1 1/20 0.35
HSD11B1 P28845 1/20 0.35
ICMT O60725 2/20 0.35
GPR3 P46089 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
MGLL Q99685 1/20 0.34
PTGES O14684 2/20 0.33
ALOX5 P09917 2/20 0.33
TLR8 Q9NR97 2/20 0.33
LIPE Q05469 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
STAT3 P40763 1/20 0.33

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
SCHEMBL14825119 0.98 RARB (0.42) RARBLTB4R2HSD11B1ICMTGPR3
SCHEMBL24336609 0.96 RARB (0.41) RARBHSD11B1ICMTGPR3NR1H2
SCHEMBL14825141 0.95 RARB (0.41) RARBLTB4R2HSD11B1ICMTGPR3
SCHEMBL25710949 0.95 RARB (0.40) RARBHSD11B1ICMTGPR3NR1H2
SCHEMBL26707566 0.95 RARB (0.39) RARBICMTGPR3NR1H2NR1H3
SCHEMBL23542260 0.94 RARB (0.42) RARBLTB4R2HSD11B1GPR3TLR8
SCHEMBL23542189 0.94 RARB (0.42) RARBLTB4R2HSD11B1GPR3TLR8
SCHEMBL24336582 0.94 RARB (0.42) RARBLTB4R2HSD11B1GPR3TLR8
SCHEMBL23542175 0.94 RARB (0.42) RARBLTB4R2HSD11B1GPR3TLR8
SCHEMBL18286389 0.94 RARB (0.40) RARBLTB4R2HSD11B1ICMTGPR3

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
EP-4400526-A1 POLYMER AND ORGANIC LIGHT-EMITTING DEVICE USING SAME LG Chem, Ltd. (KR) 2024-07-17 EP disclosed