SCHEMBL17879953

SCHEMBL17879953

Cc1cc(Oc2c(C)cc(Oc3c(C)cc(Oc4ccc(C(C)(C)c5ccc(Oc6cc(C)c(Oc7cc(C)c(Oc8cc(C)c(O)c(C)c8)c(C)c7)c(C)c6)cc5)cc4)cc3C)cc2C)cc(C)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.42
PTPN1 P18031 1/20 0.39
ESR2 Q92731 4/20 0.38
HPGD P15428 4/20 0.38
TSHR P16473 3/20 0.38
CYP3A4 P08684 2/20 0.38
AR P10275 2/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
HTR6 P50406 1/20 0.38
ESRRG P62508 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 4/20 0.36
MAPT P10636 3/20 0.36
NPC1 O15118 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
ALOX5 P09917 1/20 0.35
PTGS1 P23219 1/20 0.35

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
SCHEMBL30436898 1.00 ESR1 (0.42) ESR1PTPN1ESR2HPGDTSHR
SCHEMBL14802294 0.93 ESR1 (0.47) ESR1ESR2HPGDTSHRCYP3A4
SCHEMBL9478609 0.89 ESR1 (0.53) ESR1ESR2HPGDTSHRCYP3A4
SCHEMBL12011755 0.88 PTPN1 (0.44) ESR1PTPN1ESR2HPGDTSHR
SCHEMBL677498 0.88 PTPN1 (0.44) ESR1PTPN1ESR2HPGDTSHR
SCHEMBL17880000 0.88 PTPN1 (0.44) ESR1PTPN1ESR2HPGDTSHR
SCHEMBL21811067 0.88 PTPN1 (0.42) ESR1PTPN1ESR2ARALDH1A1
SCHEMBL17879995 0.85 LTA4H (0.41) ESR1ESR2HPGDTSHRCYP3A4
SCHEMBL17879957 0.85 LTA4H (0.41) ESR1ESR2HPGDTSHRCYP3A4
SCHEMBL21811203 0.83 CA1 (0.41) ESR1PTPN1ESR2HPGDAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9508549-B2 Methods of forming electronic devices including filling porous features with a polymer DOW GLOBAL TECHNOLOGIES LLC (US) 2016-11-29 US disclosed
US-20160185984-A1 PORE-FILL COMPOSITIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2016-06-30 US disclosed
US-20160189953-A1 METHODS OF FORMING ELECTRONIC DEVICES ROHM AND HAAS ELECTRONIC MATERIALS LLC 2016-06-30 US disclosed