Anthracene

Anthracene

SCHEMBL16634486

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

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
PTP4A3 O75365 2/20 0.44
PTP4A1 Q93096 2/20 0.44
ALDH1A1 P00352 6/20 0.44
TSHR P16473 2/20 0.44
CASP1 P29466 3/20 0.40
MAPT P10636 5/20 0.40
HSD17B10 Q99714 2/20 0.40
PTP4A2 Q12974 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PKM P14618 1/20 0.37
FGFR1 P11362 1/20 0.36
GLA P06280 1/20 0.36
RHOA P61586 1/20 0.35
RECQL P46063 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
SCHEMBL30940 0.84 TSHR (0.59) CYP3A4PTP4A3PTP4A1ALDH1A1TSHR
Anthracene SCHEMBL10612288 0.82 ALDH1A1 (0.69) ALDH1A1TSHRMAPTNPSR1KDM4E
Anthracene SCHEMBL11672628 0.78 ALDH1A1 (0.46) ALDH1A1TSHRMAPTKDM4EMEN1
SCHEMBL541021 0.78 TSHR (0.52) CYP3A4PTP4A3PTP4A1ALDH1A1TSHR
Anthracene SCHEMBL16634640 0.77 APP (0.46) CYP3A4PTP4A3PTP4A1ALDH1A1TSHR
Ether SCHEMBL540636 0.75 TSHR (0.62) CYP3A4PTP4A3PTP4A1ALDH1A1TSHR
Propionic Acid SCHEMBL27993809 0.75 TSHR (0.58) CYP3A4PTP4A3PTP4A1ALDH1A1TSHR
SCHEMBL7561802 0.73 CYP3A4 (0.45) CYP3A4ALDH1A1TSHRCASP1MAPT
SCHEMBL11882529 0.73 ALDH1A1 (0.57) ALDH1A1TSHRMAPTMEN1KMT2A
SCHEMBL10834421 0.73 ALDH1A1 (0.50) CYP3A4PTP4A3PTP4A1ALDH1A1TSHR

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