Anthracene

Anthracene

SCHEMBL16634640

C=CCOC(=O)C=CC#N.c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.46
CYP3A4 P08684 2/20 0.45
CASP1 P29466 5/20 0.40
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 3/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 5/20 0.40
CACNA1B Q00975 1/20 0.40
APBA1 Q02410 1/20 0.40
FGFR1 P11362 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.37
PKM P14618 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PTP4A3 O75365 1/20 0.36
PTP4A1 Q93096 1/20 0.36
RHOA P61586 1/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 2/20 0.34
MAPK1 P28482 2/20 0.34

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
SCHEMBL30941 0.84 MAPT (0.52) APPCYP3A4ALDH1A1HSD17B10TSHR
SCHEMBL2086750 0.84 MAPT (0.52) APPCYP3A4ALDH1A1HSD17B10TSHR
SCHEMBL7267875 0.77 APP (0.41) APPCYP3A4CASP1ALDH1A1HSD17B10
Anthracene SCHEMBL16634486 0.77 CYP3A4 (0.45) CYP3A4CASP1ALDH1A1HSD17B10TSHR
Styrene SCHEMBL4566873 0.73 CYP3A4 (0.39) APPCYP3A4CASP1ALDH1A1HSD17B10
SCHEMBL7265785 0.73 MAPT (0.47) APPCYP3A4ALDH1A1HSD17B10TSHR
SCHEMBL11228995 0.71 APP (0.47) APPCYP3A4CASP1ALDH1A1HSD17B10
SCHEMBL11229012 0.71 APP (0.47) APPCYP3A4CASP1ALDH1A1HSD17B10
SCHEMBL9547843 0.71 CASP1 (0.42) APPCYP3A4CASP1ALDH1A1MAPT
Styrene SCHEMBL1255712 0.71 CYP3A4 (0.40) APPCYP3A4CASP1ALDH1A1HSD17B10

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-9695286-B2 Rubbery polysiloxanes carrying cyanoacrylate functions and related methods for their preparation and uses therefor THE UNIVERSITY OF AKRON (US) 2017-07-04 US disclosed
US-20160215098-A1 RUBBERY POLYSILOXANES CARRYING CYANOACRYLATE FUNCTIONS AND RELATED METHODS FOR THEIR PREPARATION AND USES THEREFOR THE UNIVERSITY OF AKRON (US) 2016-07-28 US disclosed
WO-2015054357-A1 RUBBERY POLYSILOXANES CARRYING CYANOACRYLATE FUNCTIONS AND RELATED METHODS FOR THEIR PREPARATION AND USES THEREFOR THE UNIVERSITY OF AKRON (US) 2015-04-16 WO disclosed