SCHEMBL902985

SCHEMBL902985

Cc1ccc(C2(c3ccc(O)c(C)c3)C[C@H]3C[C@@H]2C[C@@H]3c2ccc(O)c(C)c2)cc1C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.40
ESR2 Q92731 6/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
POLB P06746 2/20 0.39
GAA P10253 2/20 0.39
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
XBP1 P17861 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PDE10A Q9Y233 1/20 0.31
CCR2 P41597 1/20 0.31
GFER P55789 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
SCHEMBL8509615 0.96 ESR1 (0.43) ESR1ESR2MEN1KMT2APOLB
SCHEMBL9608272 0.96 ESR1 (0.43) ESR1ESR2MEN1KMT2APOLB
SCHEMBL9608266 0.96 ESR1 (0.43) ESR1ESR2MEN1KMT2APOLB
SCHEMBL8512609 0.92 ESR1 (0.42) ESR1ESR2MEN1KMT2APOLB
SCHEMBL899859 0.89 ESR2 (0.39) ESR1ESR2MEN1KMT2APOLB
SCHEMBL899928 0.83 ESR1 (0.38) ESR1ESR2MEN1KMT2APOLB
SCHEMBL899245 0.78 MEN1 (0.33) ESR1ESR2MEN1KMT2APOLB
SCHEMBL9608269 0.73 ESR1 (0.41) ESR1ESR2MEN1KMT2APOLB
SCHEMBL9608276 0.71 MEN1 (0.50) ESR1ESR2MEN1KMT2APOLB
SCHEMBL8509481 0.71 MEN1 (0.50) ESR1ESR2MEN1KMT2APOLB

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
WO-2012044719-A1 NORBORNANE-BASED PAC BALLAST AND POSITIVE-TONE PHOTOSENSITIVE RESIN COMPOSITION ENCOMPASSING THE PAC PROMERUS LLC (US) 2012-04-05 WO disclosed