SCHEMBL8063164

SCHEMBL8063164

N#CCC(=O)NC(CO)(CO)CO

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 5/20 0.48
KMT2A Q03164 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ALDH1A1 P00352 5/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP3A4 P08684 1/20 0.35
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
GAA P10253 4/20 0.33
MAPK1 P28482 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HSD17B10 Q99714 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL8072031 0.88 MCL1 (0.48) MCL1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL8076234 0.85 MCL1 (0.47) MCL1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL8073075 0.82 MCL1 (0.44) MCL1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL8077548 0.80 HRH3 (0.44) MCL1KMT2AHRH3ALDH1A1GAA
SCHEMBL8077460 0.80 MCL1 (0.42) MCL1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL1899348 0.78 MCL1 (0.50) MCL1KMT2AALDH1A1KDM4ECYP3A4
SCHEMBL1904226 0.78 MCL1 (0.50) MCL1KMT2AALDH1A1KDM4ECYP3A4
SCHEMBL1898376 0.74 MCL1 (0.56) MCL1KMT2AALDH1A1KDM4ECYP3A4
SCHEMBL28054689 0.74 MCL1 (0.50) MCL1KMT2AALDH1A1KDM4ECYP3A4
SCHEMBL8076403 0.74 MCL1 (0.45) MCL1KMT2AALDH1A1KDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5929190-A POLYURETHANE HOMO- OR COPOLYMERS WITH TERMINAL OR BRANCH SITE 2-CYANOACETAMIDO MOIETIES ARE USEFUL FOR COATINGS AND IN INDUSTRIES EASTMAN KODAK COMPANY (US) 1999-07-27 US claimed
US-6037440-A INCREASED NETWORK DENSIT, COATINGS EASTMAN KODAK COMPANY (US) 2000-03-14 US disclosed
US-5929190-A POLYURETHANE HOMO- OR COPOLYMERS WITH TERMINAL OR BRANCH SITE 2-CYANOACETAMIDO MOIETIES ARE USEFUL FOR COATINGS AND IN INDUSTRIES EASTMAN KODAK COMPANY (US) 1999-07-27 US disclosed