SCHEMBL2849795

SCHEMBL2849795

CCCCCCCCCCCN(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.53
JAK2 O60674 1/20 0.53
RAB9A P51151 1/20 0.53
PAX8 Q06710 1/20 0.53
KCNH2 Q12809 5/20 0.50
MEN1 O00255 1/20 0.45
CASP1 P29466 1/20 0.45
BRCA1 P38398 1/20 0.45
CASP7 P55210 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TACR1 P25103 1/20 0.44
SIGMAR1 Q99720 3/20 0.44
DHFR P00374 2/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43

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
SCHEMBL44732 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL28622552 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL1204768 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL7924615 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL166835 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL985190 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL60682 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL619876 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL45379 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL983245 1.00 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4210883-B1 INVESTMENT CASTING COMPOSITIONS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-02-14 EP disclosed
US-20230348667-A1 Investment Casting Compositions and Methods 3M INNOVATIVE PROPERTIES COMPANY 2023-11-02 US disclosed
EP-4210883-A1 INVESTMENT CASTING COMPOSITIONS AND METHODS 3M Innovative Properties Company (US) 2023-07-19 EP disclosed
WO-2022053890-A1 INVESTMENT CASTING COMPOSITIONS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-03-17 WO disclosed
EP-1449955-B1 METHOD OF FLAMEPROOFING FOR POLYESTER BASED TEXTILE PRODUCT DAIKYO CHEMICAL CO LTD (JP) 2010-01-13 EP disclosed
US-7588802-B2 Agent and method for flame-retardant processing of polyester-based fiber products DAIKYO CHEMICAL CO., LTD. (JP) 2009-09-15 US disclosed
US-20080292797-A1 Agent and method for flame-retardant processing of polyester-based fiber products IWAKI TERUFUMI 2008-11-27 US disclosed
US-7425352-B2 Flameproofing agent for polyester-based textile product and method of flameproofing DAIKYO CHEMICAL CO., LTD. (JP) 2008-09-16 US disclosed
CN-1289745-C Flameproof agent for polyester-based textile product and method of flameproof DAIKYO CHEMICAL (JP) 2006-12-13 CN disclosed
CN-1606646-A Flameproof agent for polyester-based textile product and method of flameproof DAIKYO CHEMICAL (JP) 2005-04-13 CN disclosed
US-20040249029-A1 Flameproofing agent for polyester-based textile product and method of flameproofing DAIKYO CHEMICAL CO., LTD. (JP) 2004-12-09 US disclosed
EP-1449955-A1 FLAMEPROOFING AGENT FOR POLYESTER BASED TEXTILE PRODUCT AND METHOD OF FLAMEPROOFING Daikyo Chemical Co., Ltd (JP) 2004-08-25 EP disclosed
US-4292196-A Catalyst recovery UOP INC. (US) 1981-09-29 US disclosed
US-4250115-A Preparation of tertiary amines UOP INC. (US) 1981-02-10 US disclosed
US-4207260-A Preparation of tertiary amines UOP INC. (US) 1980-06-10 US disclosed