SCHEMBL8911253

SCHEMBL8911253

CC1C(O)=C(O)c2cccc3cccc1c23

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
ATM Q13315 2/20 0.36
RXFP1 Q9HBX9 2/20 0.36
POLB P06746 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
ALDH1A1 P00352 9/20 0.35
HSD17B10 Q99714 8/20 0.35
TSHR P16473 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPK1 P28482 2/20 0.35
PABPC1 P11940 1/20 0.34
HPGD P15428 6/20 0.34
GAA P10253 3/20 0.34
MAPT P10636 3/20 0.34
MCL1 Q07820 2/20 0.34
ALOX12 P18054 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 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
SCHEMBL8363928 0.73 ALDH1A1 (0.45) MEN1KMT2AATMCACNA1BAPBA1
SCHEMBL27966861 0.73 ALDH1A1 (0.45) MEN1KMT2AATMPOLBALDH1A1
SCHEMBL1667321 0.72 ALDH1A1 (0.37) MEN1KMT2AATMALDH1A1HSD17B10
SCHEMBL12485782 0.70 ALDH1A1 (0.60) MEN1KMT2AATMRXFP1POLB
SCHEMBL22160031 0.67 ALDH1A1 (0.43) MEN1KMT2AATMRXFP1POLB
SCHEMBL15319399 0.67 TYMS (0.48) MEN1KMT2AATMPOLBCACNA1B
SCHEMBL25124805 0.66 HTR2B (0.37) MEN1KMT2AATMCACNA1BALDH1A1
SCHEMBL5140862 0.66 MEN1 (0.34) MEN1KMT2APOLBALDH1A1HSD17B10
SCHEMBL28868438 0.66 ALDH1A1 (0.48) MEN1KMT2AATMRXFP1POLB
SCHEMBL30045412 0.65 HTR7 (0.40) MEN1KMT2APOLBGAA

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-5679757-A Highly organic solvent soluble, water insoluble electroluminescent polyphenylene vinylenes having pendant steroid groups and products and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-10-21 US disclosed
EP-0688353-A1 HIGHLY SOLUBLE, CONDUCTIVE, LUMINESCENT POLYPHENYLENE VINYLENES, AND PRODUCTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1995-12-27 EP disclosed
WO-1994020589-A2 HIGHLY SOLUBLE, CONDUCTIVE, LUMINESCENT POLYPHENYLENE VINYLENES, AND PRODUCTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1994-09-15 WO disclosed