SCHEMBL16569811

SCHEMBL16569811

C#CC(Sc1ccccc1)c1ccccc1.c1cc2ccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.35
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PTGS2 P35354 1/20 0.32
▸ ACP3 P15309 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MGLL Q99685 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ MAPK1 P28482 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 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
SCHEMBL6069562 0.74 CHRNB2 (0.41) CHRNB2CHRNA4TDP1PTGS2ACP3
SCHEMBL10577504 0.74 TSHR (0.36) TDP1ALDH1A1CYP1A2CYP3A4CYP2D6
SCHEMBL3716722 0.74 LMNA (0.42) LMNASMN1; SMN2L3MBTL1PKMTDP1
SCHEMBL29076099 0.71 MIF (0.33) LMNATDP1CYP2D6
SCHEMBL10577509 0.69 DPP4 (0.32) —
SCHEMBL15152119 0.69 APP (0.41) LMNASMN1; SMN2L3MBTL1PKMTDP1
SCHEMBL11403383 0.69 SMN1; SMN2 (0.38) LMNASMN1; SMN2L3MBTL1PKMTDP1
SCHEMBL8886347 0.67 TRPA1 (0.52) CHRNB2CHRNA4PTGS2ACP3ALDH1A1
SCHEMBL17993792 0.67 CYP3A4 (0.49) LMNACHRNB2CHRNA4SMN1; SMN2L3MBTL1
SCHEMBL2106150 0.67 TSHR (0.41) L3MBTL1ALDH1A1GAACYP2D6KMT2A

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-2015037567-A1 PHOTOPOLYMERIZATION INITIATOR 国立大学法人 群馬大学 (JP) 2015-03-19 — — WO disclosed
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