SCHEMBL10659853

SCHEMBL10659853

COCCn1cc(C2(c3ccc(N(C)C)cc3C)OC(=O)c3ccccc32)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
LMNA P02545 4/20 0.43
NPSR1 Q6W5P4 2/20 0.43
POLB P06746 2/20 0.43
ALOX12 P18054 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
PRKACA P17612 2/20 0.42
PRKACG P22612 2/20 0.42
PRKACB P22694 2/20 0.42
CYP3A4 P08684 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
HIF1A Q16665 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 1/20 0.40
GSK3B P49841 4/20 0.39
CNR1 P21554 3/20 0.38
CNR2 P34972 3/20 0.38
CYP2C19 P33261 2/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL10658993 0.83 LMNA (0.41) MAPTLMNANPSR1POLBALOX12
SCHEMBL7524027 0.75 MGAM (0.56) MAPTLMNANPSR1POLBALOX12
SCHEMBL10657523 0.75 LMNA (0.39) MAPTLMNANPSR1POLBALOX12
SCHEMBL3735653 0.75 MAPT (0.39) MAPTLMNANPSR1POLBALOX12
SCHEMBL10659661 0.75 TDP1 (0.34) MAPTLMNANPSR1POLBALOX12
SCHEMBL14959963 0.74 ALDH1A1 (0.45) MAPTLMNAPOLBGPR55PRKACA
SCHEMBL27291333 0.73 ALDH1A1 (0.57) PRKACAPRKACGPRKACBCYP3A4TDP1
SCHEMBL368505 0.73 LMNA (0.41) MAPTLMNANPSR1POLBALOX12
SCHEMBL3231367 0.73 GAA (0.58) ALDH1A1HSD17B10GSK3BCNR1CNR2
SCHEMBL4907834 0.73 TDP1 (0.69) MAPTLMNANPSR1POLBALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4788285-A COLOR FORMERS IN IMAGER TRANSFERRING, CARBONLESS COPYING, THERMAL RESPONISVE MARKING HILTON DAVID CHEMICAL CO. 1988-11-29 US disclosed
US-4736027-A COLOR FORMING HILTON DAVIS CHEMICAL CO. (US) 1988-04-05 US disclosed
US-4660060-A COLOR-FORMING FOR TRANSFER IMAGING; XEROGRAPHY THE HILTON-DAVIS CHEMICAL CO. (US) 1987-04-21 US disclosed
EP-0206114-A2 Novel substituted phthalides and furopyridinones, preparation thereof and use thereof as color formers HILTON-DAVIS CHEMICAL CO. (US) 1986-12-30 EP disclosed