SCHEMBL3465692

SCHEMBL3465692

C#Cc1cc2cc3c([Si](C)(C)C)c4cc5ccccc5cc4c([Si](C)(C)C)c3cc2cc1C#C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.33
ELANE P08246 1/20 0.33
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL3689065 0.85 ELANE (0.31) NQO1ELANEKDM4EALDH1A1GAA
SCHEMBL3689064 0.83 CYP1B1 (0.42) NQO1ELANEMAPTALDH1A1CA1
SCHEMBL16151203 0.82 NQO1 (0.44) NQO1ELANEMAPTKDM4ENPC1
SCHEMBL6027830 0.82
SCHEMBL31638375 0.78 CA1 (0.41) ALDH1A1HPGDCA1CA2
SCHEMBL21121993 0.78 CA1 (0.41) ALDH1A1HPGDCA1CA2
SCHEMBL14692516 0.77 NQO1 (0.40) NQO1ELANEMAPTKDM4ENPC1
SCHEMBL28765664 0.77 NQO1 (0.40) NQO1ELANEMAPTKDM4ENPC1
SCHEMBL17614920 0.77 CYP2A6 (0.40) NQO1ELANEMAPTKDM4ENPC1
SCHEMBL5012544 0.76 CYP2A6 (0.39) MAPTALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2199437-B1 Use of an organic semiconductor solution to form oriented polyacene crystals on a substrate ASAHI CHEMICAL IND (JP) 2015-07-29 EP disclosed
EP-1416069-B1 ORGANIC SEMICONDUCTOR FILM AND METHOD FOR MANUFACTURE THEREOF ASAHI CHEMICAL IND (JP) 2010-10-27 EP disclosed
EP-2199437-A2 Organic semiconductor solution Asahi Kasei Kabushiki Kaisha (JP) 2010-06-23 EP disclosed
US-7061010-B2 Organic semiconductor element ASAHI KASEI KABUSHIKI KAISHA (JP) 2006-06-13 US disclosed
US-20050258417-A1 Organic semicondutor element ASAHI KASEI KABUSHIKI KAISHA (JP) 2005-11-24 US disclosed
EP-1416069-A1 ORGANIC SEMICONDUCTOR ELEMENT Asahi Kasei Kabushiki Kaisha (JP) 2004-05-06 EP disclosed