SCHEMBL9207797

SCHEMBL9207797

CCCCCCC(N)C(O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.58
AOC3 Q16853 2/20 0.51
ALDH1A1 P00352 2/20 0.49
ASAH1 Q13510 1/20 0.49
ACER2 Q5QJU3 1/20 0.49
LMNA P02545 2/20 0.48
ADRA2A P08913 1/20 0.48
ADRA2C P18825 1/20 0.48
HIF1A Q16665 1/20 0.48
KDM4E B2RXH2 1/20 0.48
NAAA Q02083 2/20 0.45
SPHK1 Q9NYA1 1/20 0.44
GMNN O75496 1/20 0.44
POLB P06746 1/20 0.44
CYP2D6 P10635 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL9206136 0.98 CSNK1E (0.55) CSNK1EAOC3ALDH1A1ASAH1ACER2
SCHEMBL21278557 0.93 AOC3 (0.54) CSNK1EAOC3ALDH1A1ASAH1ACER2
SCHEMBL8125880 0.93 AOC3 (0.54) CSNK1EAOC3ALDH1A1ASAH1ACER2
SCHEMBL851371 0.85 AOC3 (0.62) CSNK1EAOC3ALDH1A1LMNAADRA2A
SCHEMBL8135905 0.85 AOC3 (0.62) CSNK1EAOC3ALDH1A1LMNAADRA2A
Hydrochloric Acid SCHEMBL3008842 0.84 AOC3 (0.61) CSNK1EAOC3ALDH1A1LMNAADRA2A
SCHEMBL19391254 0.82 CSNK1E (0.57) CSNK1EAOC3ALDH1A1ASAH1ACER2
SCHEMBL10327288 0.82 CSNK1E (0.57) CSNK1EAOC3ALDH1A1ASAH1ACER2
SCHEMBL8001480 0.81 SLC2A1 (0.49) CSNK1EAOC3LMNAKDM4ESPHK1
Water SCHEMBL11439293 0.81 CSNK1E (0.51) CSNK1EALDH1A1LMNANAAASPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9216999-B2 Substituted pyrrolo[2,3-h][1,6]naphthyridines and compositions thereof as JAK inhibitors NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-22 US disclosed
EP-0485069-B1 Process for producing optically active amines SUMITOMO CHEMICAL CO (JP) 1995-02-15 EP disclosed
US-5250546-A Administering as therapy for spastic paralysis; glutamic acid blocking agent; agricultural chemicals NIPPON CHEMIPHAR CO., LTD. (JP) 1993-10-05 US disclosed
US-5200561-A PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-06 US disclosed
US-5145998-A Reduction of oxime or silyloxime SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-09-08 US disclosed
EP-0237305-B1 A METHOD FOR PRODUCING OPTICALLY ACTIVE AMINES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-03 EP disclosed
EP-0485069-A1 Process for producing optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-13 EP disclosed
EP-0177245-B1 AMINO-ALCOHOL DERIVATIVES AND PROCESSES FOR THEIR PREPARATION NIPPON CHEMIPHAR CO., LTD. (JP) 1991-04-10 EP disclosed
EP-0237305-A2 A method for producing optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-09-16 EP disclosed