SCHEMBL7094986

SCHEMBL7094986

NC(=O)CCC(N)C(=O)c1ccc(O)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
GAA P10253 2/20 0.50
RECQL P46063 2/20 0.50
DBH P09172 1/20 0.50
CA2 P00918 6/20 0.43
CA1 P00915 5/20 0.43
CA12 O43570 4/20 0.43
CA7 P43166 4/20 0.43
CA9 Q16790 4/20 0.43
CA14 Q9ULX7 4/20 0.43
ALOX15 P16050 2/20 0.43
PTGS2 P35354 2/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL7094989 1.00 KDM4E (0.50) KDM4EGAARECQLDBHCA2
SCHEMBL7523284 0.87 KDM4E (0.50) KDM4EGAARECQLDBHCA2
SCHEMBL8107388 0.86 ESR1 (0.40) KDM4EGAARECQLDBHCA2
SCHEMBL2912663 0.86 ESR1 (0.40) KDM4EGAARECQLDBHCA2
SCHEMBL4658683 0.81 BLM (0.47) KDM4EGAARECQLCA2CA1
SCHEMBL4658680 0.81 BLM (0.47) KDM4EGAARECQLCA2CA1
SCHEMBL8935094 0.77 CA12 (0.43) KDM4EGAARECQLDBHCA2
SCHEMBL6286721 0.77 KMT2A (0.43) GAACA2CA1ALOX15BLM
SCHEMBL29634956 0.76 BLM (0.53) GAARECQLALOX15BLMPMP22
SCHEMBL1970885 0.74 BLM (0.47) KDM4EGAARECQLCA2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635577-B1 Screen for inhibitors of melanin biosynthesis BASF AG (DE) 2003-08-27 EP disclosed
US-5538752-A APPLYING PRESERVATIVES TO PLANTS TO INHIBIT DECAY REGENTS OF THE UNIV. OF MINNESOTA (US) 1996-07-23 US disclosed
EP-0635577-A2 Screen for inhibitors of melanin biosynthesis AMERICAN CYANAMID COMPANY (US) 1995-01-25 EP disclosed
EP-0363792-B1 Melanin production BIOSOURCE GENETICS CORP (US) 1995-01-18 EP disclosed
WO-1990004029-A1 MELANIN PRODUCTION BIOSOURCE GENETICS CORPORATION (US) 1990-04-19 WO disclosed
EP-0363792-A1 Melanin production BIOSOURCE GENETICS CORPORATION (US) 1990-04-18 EP disclosed