SCHEMBL16273148

SCHEMBL16273148

Cc1ccc2c(c1)oc1c([Si](C)(C)C)cccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 2/20 0.38
MAOB P27338 1/20 0.38
DYRK1A Q13627 1/20 0.37
CDC25A P30304 1/20 0.35
CDC25C P30307 1/20 0.35
POLB P06746 3/20 0.35
MAPT P10636 3/20 0.35
TP53 P04637 2/20 0.35
KDM4E B2RXH2 4/20 0.35
NPC1 O15118 4/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
CYP1A2 P05177 1/20 0.34
PSMB8 P28062 1/20 0.34
KEAP1 Q14145 1/20 0.34
KMT2A Q03164 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
SCHEMBL16261664 0.87 KDM4E (0.41) ALDH1A1HPGDHSD17B10POLBMAPT
SCHEMBL20726241 0.81 ALDH1A1 (0.40) ALDH1A1HPGDGAAHSD17B10MAOB
SCHEMBL14565445 0.81 CYP1A2 (0.46) ALDH1A1HPGDGAAHSD17B10MAOB
SCHEMBL8078591 0.80 ALOX5 (0.44) ALDH1A1HPGDHSD17B10MAPTKDM4E
SCHEMBL13563983 0.80 MAOB (0.48) ALDH1A1HPGDGAAHSD17B10MAOB
SCHEMBL13564024 0.79 DYRK1A (0.49) ALDH1A1HPGDGAAMAOBDYRK1A
SCHEMBL16441666 0.78 KMT2A (0.38) ALDH1A1HPGDHSD17B10DYRK1APOLB
SCHEMBL24462575 0.78 KMT2A (0.40) ALDH1A1HPGDGAAHSD17B10MAOB
SCHEMBL16273131 0.78 ALDH1A1 (0.41) ALDH1A1HPGDGAAHSD17B10MAOB
SCHEMBL20829181 0.78 MAOB (0.39) ALDH1A1HPGDGAAHSD17B10MAOB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140353646-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2014-12-04 US disclosed
US-20140353646-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2014-12-04 US disclosed