SCHEMBL8664852

SCHEMBL8664852

Clc1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3ccccc3c(-c3ccc(Oc4ccccc4)cc3)c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
TSHR P16473 2/20 0.54
POLB P06746 1/20 0.54
BLM P54132 1/20 0.54
DHODH Q02127 1/20 0.49
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
CYP2C19 P33261 2/20 0.44
GSTP1 P09211 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP2D6 P10635 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL574096 0.84 ESR1 (0.53) CYP1A2ESR1ESR2KDM4ESMN1; SMN2
SCHEMBL29416110 0.84 ESR1 (0.53) CYP1A2ESR1ESR2KDM4ESMN1; SMN2
SCHEMBL30345966 0.83 AURKA (0.52) AURKAAURKBCA1CA2
SCHEMBL432457 0.83 AURKA (0.52) AURKAAURKBCA1CA2
SCHEMBL14363729 0.83 GSTP1 (0.46) CYP1A2CYP3A4CYP2C9TSHRPOLB
SCHEMBL6762026 0.82 LTA4H (0.46) CYP1A2CYP3A4CYP2C9TSHRPOLB
SCHEMBL12721909 0.82 LTA4H (0.55) TSHRDHODHGSTP1KMT2AKDM4E
SCHEMBL30662434 0.82 LTA4H (0.55) TSHRGSTP1KMT2AKDM4ENPC1
SCHEMBL13158754 0.81 GSTP1 (0.43) CYP1A2CYP3A4CYP2C9TSHRPOLB
SCHEMBL8664846 0.81 CYP1A2 (0.49) CYP1A2CYP3A4CYP2C9TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0429821-B1 Chemiluminescent solution based on substituted anthracene OMNIGLOW CORP (US) 1998-12-09 EP claimed
US-5232635-A CHEMILUMINESCENT SOLUTION BASED ON SUBSTITUTED ANTHRACENS AMERICAN CYANAMID COMPANY (US) 1993-08-03 US claimed
EP-0429821-A2 Chemiluminescent solution based on substituted anthracene AMERICAN CYANAMID COMPANY (US) 1991-06-05 EP claimed
EP-0429821-B1 Chemiluminescent solution based on substituted anthracene OMNIGLOW CORP (US) 1998-12-09 EP disclosed
US-5232635-A CHEMILUMINESCENT SOLUTION BASED ON SUBSTITUTED ANTHRACENS AMERICAN CYANAMID COMPANY (US) 1993-08-03 US disclosed
EP-0429821-A2 Chemiluminescent solution based on substituted anthracene AMERICAN CYANAMID COMPANY (US) 1991-06-05 EP disclosed