SCHEMBL17322345

SCHEMBL17322345

OBOc1ccc(N(c2ccc3oc4ccccc4c3c2)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.39
▸ MAPT P10636 5/20 0.35
▸ NPC1 O15118 4/20 0.35
▸ ALDH1A1 P00352 7/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ KDM4E B2RXH2 6/20 0.33
▸ HPGD P15428 6/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ ACSL1 P33121 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
SCHEMBL25608187 0.85 NPC1 (0.40) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL17658595 0.85 ALOX5 (0.37) —
SCHEMBL18212070 0.84 NPC1 (0.41) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL18212124 0.83 PLA2G2A (0.42) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL17083563 0.82 MAPT (0.40) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL29294357 0.82 MGLL (0.36) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL31195961 0.82 AHR (0.43) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL27111889 0.82 AHR (0.43) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL17285617 0.81 HPGD (0.39) LMNAMAPTNPC1ALDH1A1RAB9A
SCHEMBL22259437 0.81 NPC1 (0.41) LMNAMAPTNPC1ALDH1A1RAB9A

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
US-20150357575-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-10 — — US disclosed
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