SCHEMBL14980969

SCHEMBL14980969

CC(=O)c1ccc2ccc3c(c2c1)C1C(C3)C2CC1C1C3C=CC(C3)C21

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.32
HSD17B1 P14061 1/20 0.31
CYP2A6 P11509 1/20 0.31
APEX1 P27695 1/20 0.31
RECQL P46063 1/20 0.31
CDK8 P49336 1/20 0.30

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
SCHEMBL4405533 0.74 HTR2A (0.42) ALDH1A1CYP2A6
SCHEMBL4401568 0.68
SCHEMBL4448561 0.67
SCHEMBL4405528 0.64
SCHEMBL4448559 0.64 CYP2A6 (0.32) CYP2A6
SCHEMBL13344997 0.64 MTNR1A (0.50) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL4405529 0.64 MTNR1A (0.45) ALDH1A1
SCHEMBL4403390 0.63
SCHEMBL4402536 0.62
SCHEMBL4401575 0.60 MTNR1A (0.37)

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-2447775-B1 Resist underlayer film composition and patterning process using the same SHINETSU CHEMICAL CO (JP) 2013-05-29 EP disclosed