SCHEMBL18490739

SCHEMBL18490739

Cc1ccccc1-c1c(C)ccc(Sc2c(C)ccc3[nH]c4ccccc4c23)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MAPK14 Q16539 1/20 0.39
▸ GABRP O00591 4/20 0.38
▸ GABRD O14764 4/20 0.38
▸ GABRA1 P14867 4/20 0.38
▸ GABRB1 P18505 4/20 0.38
▸ GABRG2 P18507 4/20 0.38
▸ GABRB3 P28472 4/20 0.38
▸ GABRA5 P31644 4/20 0.38
▸ GABRA3 P34903 4/20 0.38
▸ GABRA2 P47869 4/20 0.38
▸ GABRB2 P47870 4/20 0.38
▸ GABRA4 P48169 4/20 0.38
▸ GABRE P78334 4/20 0.38
▸ GABRA6 Q16445 4/20 0.38
▸ GABRG1 Q8N1C3 4/20 0.38
▸ GABRG3 Q99928 4/20 0.38
▸ GABRQ Q9UN88 4/20 0.38

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
SCHEMBL20808644 0.80 MEN1 (0.54) MEN1MAPTKMT2AMAPK14GABRP
SCHEMBL21726235 0.75 PARP1 (0.49) MEN1MAPTKMT2AMAPK14GABRP
SCHEMBL23816807 0.71 GABRP (0.50) MEN1MAPTKMT2AMAPK14GABRP
SCHEMBL21600432 0.71 GABRP (0.44) MEN1MAPTKMT2AMAPK14GABRP
SCHEMBL24860213 0.71 GABRP (0.44) MEN1MAPTKMT2AMAPK14GABRP
SCHEMBL20934479 0.69 KIF11 (0.56) MEN1MAPTKMT2AGABRPGABRD
SCHEMBL29726987 0.69 MEN1 (0.58) MEN1MAPTKMT2AGABRPGABRD
SCHEMBL11094675 0.69 MEN1 (0.58) MEN1MAPTKMT2AGABRPGABRD
SCHEMBL19573771 0.67 KIF11 (0.54) MEN1MAPTKMT2AMAPK14GABRP
SCHEMBL29119795 0.67 CDK4 (0.44) MEN1MAPTKMT2AGABRPGABRD

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-2017023126-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 2017-02-09 — — WO disclosed
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