SCHEMBL1842425

SCHEMBL1842425

N[C@](CC(=O)O)(Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
ARG1 P05089 2/20 0.55
ARG2 P78540 2/20 0.55
SLC6A2 P23975 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
AKR1B1 P15121 1/20 0.43
CYP2C19 P33261 4/20 0.41
KEAP1 Q14145 1/20 0.41
BLM P54132 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
CYP2C9 P11712 2/20 0.40
FDPS P14324 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP1A2 P05177 2/20 0.39
SLC13A5 Q86YT5 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39

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
SCHEMBL12583604 1.00 HIF1A (0.60) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL11265744 1.00 HIF1A (0.60) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL8351006 0.88 SMN1; SMN2 (0.69) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL2212930 0.85 SMN1; SMN2 (0.60) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL366770 0.82 SMN1; SMN2 (0.62) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL7924236 0.82 SMN1; SMN2 (0.62) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL22190022 0.82 SMN1; SMN2 (0.62) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL366771 0.82 SMN1; SMN2 (0.62) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL29278348 0.81 ARG1 (0.60) HIF1ASMN1; SMN2ARG1ARG2SLC6A2
SCHEMBL343695 0.81 ARG1 (0.60) HIF1ASMN1; SMN2ARG1ARG2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8957205-B2 Cycloalkane carboxamide derivatives and production process of same SEIKAGAKU CORPORATION (JP) 2015-02-17 US disclosed
US-8829209-B2 Cycloalkylcarbonylamino acid ester derivative and process for producing the same SEIKAGAKU CORPORATION (JP) 2014-09-09 US disclosed
CN-101370773-B Cycloalkanecarboxamide derivative and method for producing same SEIKAGAKU KOGYO CO LTD 2014-04-09 CN disclosed
EP-2036920-B1 CYCLOALKYLCARBONYLAMINO ACID ESTER DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SEIKAGAKU KOGYO CO LTD (JP) 2011-05-18 EP disclosed
US-20090156805-A1 Cycloalkane Carboxamide Derivatives and Production Process of Same SEIKAGAKU CORPORATION (JP) 2009-06-18 US disclosed
US-20090137799-A1 Cycloalkylcarbonylamino Acid Ester Derivative and Process for Producing The Same SEIKAGAKU CORPORATION (JP) 2009-05-28 US disclosed
EP-2036920-A1 CYCLOALKYLCARBONYLAMINO ACID ESTER DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SEIKAGAKU CORPORATION (JP) 2009-03-18 EP disclosed
CN-101370773-A Cycloalkanecarboxamide derivative and method for producing same SEIKAGAKU KOGYO CO LTD (JP) 2009-02-18 CN disclosed
EP-1972615-A1 CYCLOALKANECARBOXAMIDE DERIVATIVE AND METHOD FOR PRODUCING SAME SEIKAGAKU CORPORATION (JP) 2008-09-24 EP disclosed
US-6818732-B2 ABLE TO ELIMINATE CHAIN TRANSFER AND CHAIN TERMINATION SIDE REACTIONS FROM THESE POLYMERIZATIONS FOR NARROW MOLECULAR WEIGHT DISTRIBUTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-11-16 US disclosed
US-20030083460-A1 Transition metal initiators for controlled poly (beta-peptide) synthesis from beta-lactam monomers NATIONAL SCIENCE FOUNDATION 2003-05-01 US disclosed
WO-2003020797-A1 TRANSITION METAL INITIATORS FOR CONTROLLED POLY (BETA-PEPTIDE) SYNTHESIS FROM BETA-LACTAM MONOMERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-03-13 WO disclosed
EP-0394311-A1 RENIN INHIBITING PEPTIDES THAT CONTAIN AMINO AND HYDROXY DICARBOXYLIC ACIDS THE UPJOHN COMPANY (US) 1990-10-31 EP disclosed
WO-1989004833-A1 RENIN INHIBITING PEPTIDES THAT CONTAIN AMINO AND HYDROXY DICARBOXYLIC ACIDS THE UPJOHN COMPANY (US) 1989-06-01 WO disclosed
US-4339589-A Preparation of 4-substituted oxazolidin-5-ones BASF AKTIENGESELLSCHAFT (DE) 1982-07-13 US disclosed
US-4264771-A Alkylation of substituted oxazolinone-(5) compounds BASF AKTIENGESELLSCHAFT (DE) 1981-04-28 US 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 (2 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-20090156805-A1 Cycloalkane Carboxamide Derivatives and Production Process of Same CTSK, CTSS, CTSB HIF1A 2255/4885SMN1; SMN2 4556/4885ARG1 485/4885
US-20090137799-A1 Cycloalkylcarbonylamino Acid Ester Derivative and Process for Producing The Same CTSK, CTSS, CTSE HIF1A 3184/4885SMN1; SMN2 4555/4885ARG1 110/4885

“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.