SCHEMBL12019129

SCHEMBL12019129

CC(C)Oc1ccc(C(C)c2ccc(O)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.67
ESR2 Q92731 2/20 0.67
PDCD1 Q15116 1/20 0.67
CD274 Q9NZQ7 1/20 0.67
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
MITF O75030 1/20 0.49
PARP10 Q53GL7 1/20 0.46
ALDH1A3 P47895 1/20 0.44
POLB P06746 1/20 0.43
GLA P06280 1/20 0.42
ACACB O00763 3/20 0.41
ACACA Q13085 1/20 0.41
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL12203936 0.89 ALDH1A3 (0.52) ESR1ESR2PDCD1CD274KMT2A
SCHEMBL28485 0.89 KMT2A (0.56) ESR1ESR2PDCD1CD274KMT2A
SCHEMBL12804466 0.83 ESR1 (0.73) ESR1ESR2PDCD1CD274KMT2A
SCHEMBL863444 0.83 ESR2 (0.58) ESR1ESR2KMT2AMEN1MITF
SCHEMBL1619622 0.83 KMT2A (0.64) ESR1ESR2KMT2AMEN1PARP10
SCHEMBL26946 0.82 ESR1 (1.00) ESR1ESR2PDCD1CD274KMT2A
SCHEMBL10593295 0.82 ESR1 (1.00) ESR1ESR2PDCD1CD274KMT2A
SCHEMBL24465176 0.81 ESR2 (0.70) ESR1ESR2PDCD1CD274KMT2A
SCHEMBL3642097 0.80 KMT2A (0.49) ESR1ESR2PDCD1CD274KMT2A
Methane SCHEMBL21952131 0.79 ESR1 (0.94) ESR1ESR2PDCD1CD274KMT2A

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
EP-2492748-A1 Lithographic printing plate precursor and plate making method thereof Fujifilm Corporation (JP) 2012-08-29 EP disclosed
EP-2378363-A1 POLYCARBONATE RESIN, COATING LIQUID CONTAINING SAME, AND ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY Idemitsu Kosan Co., Ltd. (JP) 2011-10-19 EP disclosed