SCHEMBL7975485

SCHEMBL7975485

CC(CCC(C)(c1ccc(O)c(Cl)c1)c1ccc(O)c(Cl)c1)(c1ccc(O)cc1)c1ccc(O)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.49
ESR2 Q92731 7/20 0.49
CYP3A4 P08684 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CACNA1B Q00975 1/20 0.43
CHEK1 O14757 1/20 0.42
FYN P06241 1/20 0.42
PDGFRB P09619 1/20 0.42
PIM1 P11309 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
GRK5 P34947 1/20 0.42
MAP2K2 P36507 1/20 0.42
MAPK8 P45983 1/20 0.42
CDK8 P49336 1/20 0.42
RPS6KA3 P51812 1/20 0.42
PRKX P51817 1/20 0.42
JAK3 P52333 1/20 0.42
LIMK1 P53667 1/20 0.42
BTK Q06187 1/20 0.42

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
SCHEMBL21819899 0.86 ESR1 (0.53) ESR1ESR2CHEK1FYNPDGFRB
SCHEMBL7972783 0.86 CHEK1 (0.42) ESR1ESR2CYP3A4ALDH1A1CACNA1B
SCHEMBL7969173 0.82 ESR1 (0.61) ESR1ESR2CYP3A4ALDH1A1CACNA1B
SCHEMBL730689 0.81 ESR1 (0.67) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL7946326 0.80 HSD17B10 (0.43) ESR1ESR2CYP3A4ALDH1A1CHEK1
SCHEMBL5078080 0.80 ESR1 (0.46) ESR1ESR2ALDH1A1TSHRHSD17B10
SCHEMBL30713707 0.80 ESR1 (0.61) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL10865833 0.80 ESR1 (0.61) ESR1ESR2CYP3A4ALDH1A1TSHR
SCHEMBL8915558 0.80 ESR1 (0.37) ESR1ESR2CYP3A4ALDH1A1CACNA1B
SCHEMBL7594834 0.79 CHEK1 (0.68) ESR1ESR2CYP3A4ALDH1A1CHEK1

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-6268462-B1 Branched polycarbonate resin and process for the preparation thereof IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-07-31 US disclosed
EP-1008608-A1 BRANCHED POLYCARBONATE RESIN AND PROCESS FOR THE PREPARATION THEREOF IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-06-14 EP disclosed
US-4415725-A MOLDING MATERIALS; BLOW MOLDING; BOTTLES; FILMS GENERAL ELECTRIC CO. (US) 1983-11-15 US disclosed