SCHEMBL1986802

SCHEMBL1986802

CC(C)(C)OC(=O)N1CCCCC1C(=O)N1CCCC(C(=O)NC(CCCc2ccccc2)CCCc2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 5/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
HSD17B10 Q99714 1/20 0.46
UCHL1 P09936 1/20 0.44
WNT3 P56703 2/20 0.44
SFRP1 Q8N474 2/20 0.44
F2 P00734 1/20 0.44
PRSS1 P07477 1/20 0.44
KDM4E B2RXH2 2/20 0.44
CTSL P07711 1/20 0.43
CTSK P43235 1/20 0.43
HRH2 P25021 1/20 0.43
HRH1 P35367 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
SCHEMBL1980404 0.93 HSD17B10 (0.53) FKBP1AKMT2AMEN1HSD17B10UCHL1
SCHEMBL13938201 0.89 FKBP1A (0.48) FKBP1AKMT2AF2PRSS1KDM4E
SCHEMBL13938199 0.88 KDM4E (0.50) KMT2AMEN1KDM4E
SCHEMBL1979768 0.88 FKBP1A (0.52) FKBP1AKMT2AMEN1F2PRSS1
SCHEMBL1979225 0.88 USP30 (0.50) KMT2AMEN1KDM4E
SCHEMBL1979169 0.88 FKBP1A (0.55) FKBP1AKMT2AMEN1F2PRSS1
SCHEMBL12597632 0.84 KDM4E (0.52) FKBP1AKMT2AKDM4E
SCHEMBL13938196 0.83 FKBP1A (0.49) FKBP1AF2PRSS1CTSLCTSK
SCHEMBL1979688 0.80 STS (0.60) KMT2AKDM4E
SCHEMBL13938176 0.79 STS (0.56) KMT2ASFRP1KDM4E

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-1326834-B1 2-SUBSTITUTED HETEROCYCLIC COMPOUNDS H LEE MOFFITT CANCER CT & RES (US) 2011-06-29 EP disclosed