SCHEMBL10698966

SCHEMBL10698966

CC(c1ccc(O)cc1)(c1ccc(O)cc1)c1ccc(Oc2ccccc2)cc1.c1cc2cc-2c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.58
ESR2 Q92731 5/20 0.58
LTA4H P09960 3/20 0.56
NR1H2 P55055 2/20 0.56
BAX Q07812 1/20 0.56
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ABL1 P00519 2/20 0.44
ABCB1 P08183 2/20 0.44
BCR P11274 2/20 0.44
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
RAB9A P51151 1/20 0.42
NR1H3 Q13133 1/20 0.39
GPR84 Q9NQS5 1/20 0.39

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
SCHEMBL23082207 0.89 ESR2 (0.63) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL5375641 0.83 ESR1 (0.64) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL10038560 0.81 LTA4H (0.57) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL23082081 0.80 ESR1 (0.45) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL7035776 0.80 LTA4H (0.69) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL12994049 0.80 ESR1 (0.70) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL9713335 0.79 ESR1 (0.51) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL23082117 0.79 ESR1 (0.46) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL18973789 0.78 ESR1 (0.74) ESR1ESR2LTA4HNR1H2BAX
SCHEMBL21360606 0.78 ESR1 (0.64) ESR1ESR2LTA4HNR1H2BAX

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-0277627-A1 Polyformal resins and process for producing said resins IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-08-10 EP disclosed