SCHEMBL1879654

SCHEMBL1879654

COC(=O)[C@@H](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
SCHEMBL1884230 1.00 ATM (0.68) ATMALDH1A1THRBCYP2C9CYP2C19
SCHEMBL803579 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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028251-B1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER ETHYL CORPORATION (US) 1983-03-16 EP 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-114573473-B Preparation method of (R) -alpha-aryl alanine ester derivative 浙江工业大学 2023-11-28 CN disclosed
CN-114573473-A Preparation method of (R) -alpha-aryl alanine ester derivative 浙江工业大学 2022-06-03 CN disclosed
US-11325875-B2 Compound having chiral spirobiindane skeleton and preparation method therefor ZHEJIANG JIUZHOU PHARM CO LTD (CN) 2022-05-10 US disclosed
EP-1451133-B1 P-CHIRAL PHOSPHOLANES AND PHOSPHOCYCLIC COMPOUNDS AND THEIR USE IN ASYMMETRIC CATALYTIC REACTIONS PENN STATE RES FOUND (US) 2017-10-25 EP disclosed
EP-1451133-B1 P-CHIRAL PHOSPHOLANES AND PHOSPHOCYCLIC COMPOUNDS AND THEIR USE IN ASYMMETRIC CATALYTIC REACTIONS PENN STATE RES FOUND (US) 2017-10-25 EP disclosed
WO-2017107789-A1 COMPOUND HAVING CHIRAL SPIROBIINDANE SKELETON AND PREPARATION METHOD THEREFOR 浙江九洲药业股份有限公司 2017-06-29 WO disclosed
US-9029571-B2 Device and method for evaluating organic material for organic solar cell NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2015-05-12 US disclosed
EP-0028251-B1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER ETHYL CORPORATION (US) 1983-03-16 EP disclosed
EP-0028251-A1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER. ETHYL CORP (US) 1981-05-13 EP disclosed
EP-0028251-A1 PROCESS FOR PRODUCING N-ACYL-D-PHENYLALANINE ESTER. ETHYL CORP (US) 1981-05-13 EP 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11325875-B2 Compound having chiral spirobiindane skeleton and preparation method therefor REN, VKORC1, NR3C2 ATM 3703/4885ALDH1A1 106/4885THRB 1272/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.