SCHEMBL19732959

SCHEMBL19732959

CCC1=C(C(=O)O)[C@@H](c2ccccc2)NC(=O)N1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.56
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TP53 P04637 1/20 0.49
THRB P10828 1/20 0.49
POLB P06746 2/20 0.48

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
SCHEMBL19732960 1.00 USP2 (0.56) USP2MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6348279 0.85 HTT (0.57) USP2MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL19752713 0.85 MEN1 (0.67) MEN1KMT2AALDH1A1SMN1; SMN2TP53
SCHEMBL19752712 0.85 MEN1 (0.67) MEN1KMT2AALDH1A1SMN1; SMN2TP53
SCHEMBL19732955 0.80 USP2 (0.79) USP2MEN1KMT2AALDH1A1TP53
SCHEMBL19732923 0.80 USP2 (0.79) USP2MEN1KMT2AALDH1A1TP53
SCHEMBL13789190 0.80 USP2 (0.79) USP2MEN1KMT2AALDH1A1TP53
SCHEMBL13425500 0.79 GAA (0.46) MEN1KMT2AALDH1A1POLB
SCHEMBL3398109 0.77 TP53 (0.44) MEN1KMT2ATP53
SCHEMBL3398102 0.77 TP53 (0.44) MEN1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260446-A1 ENANTIOSELECTIVE SYNTHESIS OF DIHYDROPYRIMIDINONES AND HEXAHYDROPYRIMIDINONES Universitat de les Illes Balears (ES) 2017-12-27 EP disclosed