SCHEMBL120598

SCHEMBL120598

CSCC[C@@H](C(=O)O)N(C)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.40
FABP7 O15540 2/20 0.40
KMT2A Q03164 2/20 0.39
FDFT1 P37268 2/20 0.38
CASP3 P42574 1/20 0.38
EPHX2 P34913 1/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
MDM4 O15151 1/20 0.36
TP53 P04637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL29399007 1.00 FABP5 (0.40) FABP5FABP7KMT2AFDFT1CASP3
SCHEMBL30116841 0.91 ITGB3 (0.38) FABP5FABP7KMT2AFDFT1
SCHEMBL26312569 0.90 KMT2A (0.40) FABP5FABP7KMT2AFDFT1CASP3
SCHEMBL30686148 0.90 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL30792912 0.90 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL24633869 0.90 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL29277314 0.90 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL21896097 0.87 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL30670326 0.87 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2
SCHEMBL23056464 0.87 FABP5 (0.43) FABP5FABP7KMT2ACASP3EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295221-A1 EFFICIENT PEPTIDE CONDENSATION METHOD FOR DIFFICULT SEQUENCES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-09-21 US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
US-7659364-B2 N-methyl-homocysteines and their use as well as process for their production CIS BIO INTERNATIONAL (FR) 2010-02-09 US disclosed
EP-1444194-B1 N-METHYL-HOMOCYSTINES, USE THEREOF AND METHOD FOR THE PRODUCTION THEREOF CIS BIO INT (FR) 2009-12-09 EP disclosed
EP-1444194-A1 N-METHYL-HOMOCYSTINES, USE THEREOF AND METHOD FOR THE PRODUCTION THEREOF SCHERING AKTIENGESELLSCHAFT (DE) 2004-08-11 EP disclosed
US-20030120032-A1 N-methyl-homocysteines and their use as well as process for their production SCHERING AG (DE) 2003-06-26 US disclosed
WO-2003042163-A1 N-METHYL-HOMOCYSTINES, USE THEREOF AND METHOD FOR THE PRODUCTION THEREOF SCHERING AKTIENGESELLSCHAFT (DE) 2003-05-22 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 (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-20030120032-A1 N-methyl-homocysteines and their use as well as process for their production BHMT, BHMT2, AHCY FABP5 2008/4885FABP7 649/4885KMT2A 553/4885
US-20230295221-A1 EFFICIENT PEPTIDE CONDENSATION METHOD FOR DIFFICULT SEQUENCES NGLY1, VIP, DNPEP FABP5 2084/4885FABP7 1329/4885KMT2A 3727/4885

“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.