SCHEMBL14948640

SCHEMBL14948640

CCC(C)CCCC(C)C1CCC2C3CCC4CC(OC(=O)c5cc(N)cc(N)c5)CCC4(C)C3CCC12C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 4/20 0.56
POLA1 P09884 1/20 0.55
VDR P11473 2/20 0.55
USP2 O75604 1/20 0.55
ST6GAL1 P15907 1/20 0.53
ABCC4 O15439 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
SCHEMBL27918611 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL141358 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL17124793 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL21510590 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL17123439 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL25211248 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL20488562 0.93 CDC25A (0.66) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL12798590 0.88 CDC25A (0.62) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL15043346 0.87 VDR (0.55) CDC25APOLA1VDRUSP2ST6GAL1
SCHEMBL12774782 0.86 CDC25A (0.58) CDC25APOLA1VDRUSP2ST6GAL1

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
US-20130123438-A1 Liquid Crystal Alignment Agent, Liquid Crystal Alignment Film Manufactured Using the Same, and Liquid Crystal Display Device Including the Liquid Crystal Alignment Film CHEIL INDUSTRIES INC. (KR) 2013-05-16 US disclosed