SCHEMBL20032702

SCHEMBL20032702

COC(=O)c1ccc(-c2ccc(OCCCCO)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.70
RAB9A P51151 2/20 0.62
CYP4A11 Q02928 2/20 0.58
CYP4F2 P78329 1/20 0.58
POLB P06746 1/20 0.55
RARB P10826 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
GAA P10253 1/20 0.51
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
NPC1 O15118 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 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
SCHEMBL7332647 0.98 MAPT (0.68) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL13721594 0.98 MAPT (0.68) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL6018398 0.95 MAPT (0.77) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL1791955 0.94 MAPT (0.74) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL225009 0.94 MAPT (0.74) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL431397 0.94 MAPT (0.74) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL8962930 0.94 MAPT (0.74) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL4815928 0.92 MAPT (0.77) MAPTRAB9ACYP4A11CYP4F2RARB
SCHEMBL223429 0.90 MAPT (0.79) MAPTRAB9ACYP4A11CYP4F2POLB
SCHEMBL7321276 0.89 MAPT (0.72) MAPTRAB9ARARBL3MBTL1TDP1

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-9939555-B2 Cinnamic acid derivative, polymer thereof, and liquid crystal alignment layer comprising cured product thereof DIC CORPORATION (JP) 2018-04-10 US disclosed