SCHEMBL19055495

SCHEMBL19055495

C=C(S)/C=C(\N=C(/C)c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MAPT P10636 3/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ ATM Q13315 1/20 0.34
▸ METTL3 Q86U44 1/20 0.34
▸ G6PC1 P35575 1/20 0.34
▸ GAA P10253 3/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 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
SCHEMBL19421831 0.80 LMNA (0.35) LMNAMAPK1HTTL3MBTL1MAPT
SCHEMBL22328707 0.74 CES2 (0.37) LMNAHTTL3MBTL1MAPTCYP2D6
SCHEMBL19142681 0.73 SMN1; SMN2 (0.36) MAPTCYP1A2CYP2D6HSD17B10POLB
SCHEMBL17726017 0.73 KMT2A (0.36) LMNAMAPK1HTTL3MBTL1MAPT
SCHEMBL16373660 0.72 MAPT (0.41) LMNAMAPK1HTTL3MBTL1MAPT
SCHEMBL15434187 0.71 MEN1 (0.35) LMNAMAPK1HTTL3MBTL1MAPT
SCHEMBL16364863 0.71 LMNA (0.45) LMNAMAPK1HTTL3MBTL1MAPT
SCHEMBL19199753 0.71 KMO (0.35) LMNAMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL19882238 0.70 LMNA (0.48) LMNAMAPK1HTTL3MBTL1MAPT
SCHEMBL18600210 0.69 LMNA (0.40) LMNAMAPK1HTTL3MBTL1MAPT

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-3185328-A1 ORGANIC LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2017-06-28 — — EP disclosed
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