SCHEMBL9501070

SCHEMBL9501070

CSCCC(NC(=O)c1ccccc1)C(=O)NC(CO)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.63
ALDH1A1 P00352 1/20 0.63
CRHBP P24387 1/20 0.63
KMT2A Q03164 1/20 0.63
CRHR2 Q13324 1/20 0.63
CA2 P00918 4/20 0.59
CA1 P00915 3/20 0.59
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
NPC1 O15118 1/20 0.51
FNTA P49354 2/20 0.50
FNTB P49356 2/20 0.50
PGGT1B P53609 2/20 0.50
CTSB P07858 1/20 0.50
LTA4H P09960 1/20 0.49

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
SCHEMBL9501077 1.00 MEN1 (0.63) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL27989485 0.89 ALDH1A1 (0.62) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL1158031 0.88 CA2 (0.69) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL1158033 0.88 CA2 (0.69) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL9461939 0.88 CA2 (0.69) MEN1ALDH1A1CRHBPKMT2ACRHR2
Lithium SCHEMBL6646645 0.86 CA2 (0.67) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL6646636 0.86 CA2 (0.67) MEN1ALDH1A1CRHBPKMT2ACRHR2
Water SCHEMBL28867161 0.86 CA2 (0.67) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL1997609 0.84 MEN1 (0.69) MEN1ALDH1A1CRHBPKMT2ACRHR2
SCHEMBL1995534 0.84 MEN1 (0.69) MEN1ALDH1A1CRHBPKMT2ACRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0537185-A1 AN ENZYMATIC PROCESS FOR THE PREPARATION OF DERIVATIVES OF GROWTH HORMONE RELEASING FACTOR AND PEPTIDES USEFUL AS INTERMEDIATES IN THE PROCESS CARLBIOTECH LTD. A/S (DK) 1993-04-21 EP disclosed
WO-1991018998-A1 AN ENZYMATIC PROCESS FOR THE PREPARATION OF DERIVATIVES OF GROWTH HORMONE RELEASING FACTOR AND PEPTIDES USEFUL AS INTERMEDIATES IN THE PROCESS CARLBIOTECH LTD. A/S (DK) 1991-12-12 WO disclosed