SCHEMBL5599875

SCHEMBL5599875

CCCCCCCCCCCCCCn1cccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.57
RAB9A P51151 7/20 0.57
HTT P42858 6/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
LMNA P02545 3/20 0.57
MAPK1 P28482 3/20 0.57
NPSR1 Q6W5P4 3/20 0.57
HSP90AA1 P07900 3/20 0.57
GALR3 O60755 2/20 0.57
POLB P06746 2/20 0.57
ATM Q13315 2/20 0.57
APOBEC3A P31941 2/20 0.57
APOBEC3G Q9HC16 2/20 0.57
MAPT P10636 2/20 0.57
KDM4E B2RXH2 1/20 0.57
RAD52 P43351 1/20 0.57
PAX8 Q06710 1/20 0.57
NR2F2 P24468 1/20 0.57
NOD2 Q9HC29 1/20 0.57
ALDH1A1 P00352 2/20 0.54

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
SCHEMBL5604253 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5603811 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5604022 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL1792913 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL562381 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5602339 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5601944 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5601524 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5602162 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA
SCHEMBL5603079 1.00 NPC1 (0.57) NPC1RAB9AHTTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-3980089-A Novel heterocyclic flavoring compositions and processes INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-09-14 US claimed
CN-113481268-B Method for continuously preparing aliphatic chain-GLP-1 receptor agonist polypeptide by using microreactor 深圳市小分子新药创新中心有限公司 2022-08-23 CN disclosed
CN-108503657-B Boron-nitrogen doped fused ring aromatic hydrocarbon containing five-membered heterocycle and synthetic method and application thereof 天津理工大学 2022-08-16 CN disclosed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
CN-1314384-C Oral cavity nursing agent UNIV SOUTHERN MEDICAL (CN) 2007-05-09 CN disclosed
CN-1778288-A Oral cavity nursing agent UNIV NANFANG MEDICAL (CN) 2006-05-31 CN disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed
EP-0573650-A1 SILVER HALIDE PHOTOGRAPHIC MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1993-12-15 EP disclosed
EP-0312959-A1 Silver halide photographic emulsion FUJI PHOTO FILM CO., LTD. (JP) 1989-04-26 EP disclosed
US-4220764-A Preparation of tertiary heterocyclic amines UOP INC. (US) 1980-09-02 US disclosed
US-4179469-A Preparation of amines UOP INC. (US) 1979-12-18 US disclosed
US-3980089-A Novel heterocyclic flavoring compositions and processes INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-09-14 US disclosed