SCHEMBL803579

SCHEMBL803579

COC(=O)C(Cc1ccccc1)NC(C)=O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.68
ALDH1A1 P00352 2/20 0.67
THRB P10828 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
HSD17B10 Q99714 1/20 0.67
TACR1 P25103 1/20 0.66
POLB P06746 1/20 0.65
LMNA P02545 1/20 0.62
GLA P06280 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.60
CTSS P25774 1/20 0.60
CTSK P43235 1/20 0.60
PAM P19021 1/20 0.60
GAA P10253 1/20 0.59
RAB9A P51151 1/20 0.59

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
SCHEMBL1879654 1.00 ATM (0.68) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL1884230 1.00 ATM (0.68) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL3734223 0.94 ALDH1A1 (0.68) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL27488362 0.94 ALDH1A1 (0.68) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL16523532 0.92 HDAC1 (0.64) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL18733473 0.92 HDAC1 (0.64) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL28943620 0.90 TACR1 (0.66) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL11321133 0.89 ATM (0.63) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL16668525 0.89 ALDH1A1 (0.62) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL9020754 0.89 ALDH1A1 (0.62) ATMALDH1A1THRBCYP2C9CYP2C19

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 214 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101186549-A Method for preparing amino acid by reducing ketoxime acid ester HEBEI TECHNOLOGY UNIVERSITY (CN) 2008-05-28 CN claimed
WO-2006119283-A2 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J (US) 2006-11-09 WO claimed
US-20060251597-A1 ANTI-ODOR COMPOSITIONS AND THERAPEUTIC USE YU RUEY J 2006-11-09 US claimed
US-4496756-A Process for preparing amino acid esters ETHYL CORPORATION (US) 1985-01-29 US claimed
US-4414404-A FROM N-ACYL-ACETAMINOCINNAMIC ACID AZLACTONE ETHYL CORPORATION (US) 1983-11-08 US claimed
EP-0028251-A1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER. ETHYL CORP (US) 1981-05-13 EP claimed
US-4262092-A Process for producing N-acyl-D-phenylalanine ester ETHYL CORPORATION (US) 1981-04-14 US claimed
EP-0028251-A4 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER. ETHYL CORP (US) 1981-03-27 EP claimed
WO-1980002421-A1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER ETHYL CORP (US) 1980-11-13 WO claimed
CN-118307428-B Chiral alpha unnatural amino acid and preparation method thereof by rare noble metal complex 北京元延医药科技股份有限公司 2025-01-10 CN disclosed
CN-119199141-A Sweetener thermal cracking analysis method and application thereof 东莞市鸿馥生物科技有限公司 2024-12-27 CN disclosed
CN-118307428-A Chiral alpha unnatural amino acid and preparation method thereof by rare noble metal complex 北京元延医药科技股份有限公司 2024-07-09 CN disclosed
CN-114573473-B Preparation method of (R) -alpha-aryl alanine ester derivative 浙江工业大学 2023-11-28 CN disclosed
WO-2023222866-A1 DOSE AND REGIMEN FOR A HETEROCYCLIC PHOSPHINIC COMPOUND PHOST'IN THERAPEUTICS (FR) 2023-11-23 WO disclosed
US-4262092-A Process for producing N-acyl-D-phenylalanine ester ETHYL CORPORATION (US) 1981-04-14 US disclosed
EP-0028251-A4 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER. ETHYL CORP (US) 1981-03-27 EP disclosed
EP-0028251-A4 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER. ETHYL CORP (US) 1981-03-27 EP disclosed
WO-1980002421-A1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER ETHYL CORP (US) 1980-11-13 WO disclosed
WO-1980002421-A1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER ETHYL CORP (US) 1980-11-13 WO disclosed
US-3996288-A Method of producing aldehydes by hydroformylation AJINOMOTO CO., INC. (JA) 1976-12-07 US disclosed