SCHEMBL9412151

SCHEMBL9412151

CC(CCCCCCC(C)c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.57
ESR2 Q92731 6/20 0.57
PDCD1 Q15116 1/20 0.52
CD274 Q9NZQ7 1/20 0.52
MIF P14174 1/20 0.48
CYP2C9 P11712 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
PGR P06401 1/20 0.46
CHRM2 P08172 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
AR P10275 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
CHRM1 P11229 1/20 0.46
ALOX15 P16050 1/20 0.46
DRD1 P21728 1/20 0.46
TBXA2R P21731 1/20 0.46

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
SCHEMBL28477538 1.00 ESR1 (0.57) ESR1ESR2PDCD1CD274MIF
SCHEMBL9804621 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL20845445 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL10583267 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL6745552 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL25172266 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL3213883 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL8511827 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL9353521 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL4410688 0.92 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6228296-A None JP disclosed
JP-H06228296-A METHOD FOR MODIFYING AROMATIC POLYCARBONATE RESIN TEIJIN CHEM LTD 1994-08-16 JP disclosed