SCHEMBL5414565

SCHEMBL5414565

C(#Cc1cccc(Oc2cccc(C#Cc3ccccc3)c2-c2ccccc2)c1-c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
CYP1A2 P05177 3/20 0.44
NPC1 O15118 2/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
HPGD P15428 2/20 0.44
CYP2C19 P33261 2/20 0.44
KMT2A Q03164 2/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
APP P05067 1/20 0.43
CA12 O43570 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
RAB9A P51151 1/20 0.39
DHFR P00374 1/20 0.36
KCNH2 Q12809 3/20 0.36

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
SCHEMBL3839249 0.81 MAPT (0.59) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL28164633 0.78 MAPT (0.47) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL26654861 0.78 NPC1 (0.47) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL26655206 0.76 MAPT (0.46) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL5414561 0.74 MAPT (0.47) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL7071245 0.74 MAPT (0.47) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL7061161 0.73 ALDH1A1 (0.66) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL21655105 0.73 ALDH1A1 (0.45) MAPTCYP1A2NPC1MEN1ALDH1A1
SCHEMBL21655108 0.72 KCNH2 (0.50) NPC1MEN1ALDH1A1KMT2AKDM4E
SCHEMBL16719414 0.72 NPC1 (0.56) MAPTCYP1A2NPC1MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7307137-B2 CROSSLINKING SHELL-CORE POLYMER HONEYWELL INTERNATIONAL INC. (US) 2007-12-11 US claimed
EP-1373358-A4 LOW DIELECTRIC CONSTANT MATERIALS AND METHODS OF PREPARATION THEREOF HONEYWELL INT INC (US) 2005-03-16 EP claimed
US-20040158024-A1 CROSSLINKING SHELL-CORE POLYMER HONEYWELL INTERNATIONAL INC. 2004-08-12 US claimed
EP-1373358-A1 LOW DIELECTRIC CONSTANT MATERIALS AND METHODS OF PREPARATION THEREOF Honeywell International, Inc. (US) 2004-01-02 EP claimed
WO-2002081546-A1 LOW DIELECTRIC CONSTANT MATERIALS AND METHODS OF PREPARATION THEREOF HONEYWELL INTERNATIONAL INC. (US) 2002-10-17 WO claimed
US-7307137-B2 CROSSLINKING SHELL-CORE POLYMER HONEYWELL INTERNATIONAL INC. (US) 2007-12-11 US disclosed
US-20050182151-A1 Low dielectric constant polyorganosilicon materials generated from polycarbosilanes APEN PAUL (US) 2005-08-18 US disclosed
EP-1373358-A4 LOW DIELECTRIC CONSTANT MATERIALS AND METHODS OF PREPARATION THEREOF HONEYWELL INT INC (US) 2005-03-16 EP disclosed
US-6841256-B2 Low dielectric constant polyorganosilicon materials generated from polycarbosilanes HONEYWELL INTERNATIONAL INC. (US) 2005-01-11 US disclosed
US-20040158024-A1 CROSSLINKING SHELL-CORE POLYMER HONEYWELL INTERNATIONAL INC. 2004-08-12 US disclosed
EP-1373358-A1 LOW DIELECTRIC CONSTANT MATERIALS AND METHODS OF PREPARATION THEREOF Honeywell International, Inc. (US) 2004-01-02 EP disclosed
WO-2002081546-A1 LOW DIELECTRIC CONSTANT MATERIALS AND METHODS OF PREPARATION THEREOF HONEYWELL INTERNATIONAL INC. (US) 2002-10-17 WO disclosed