SCHEMBL10658014

SCHEMBL10658014

CCN(CC)c1ccc(C2(c3c(C)n(CCOc4ccccc4)c4ccccc34)OC(=O)c3ccccc32)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 4/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 2/20 0.38
NPSR1 Q6W5P4 5/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
ALOX12 P18054 1/20 0.38
GPR55 Q9Y2T6 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 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
SCHEMBL10593352 0.91 CYP3A4 (0.41) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL3735653 0.91 MAPT (0.39) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL10657528 0.90 MAPT (0.39) MEN1KMT2APOLBTSHRTP53
SCHEMBL10656352 0.88 MAPT (0.37) MEN1KMT2APOLBTSHRTP53
SCHEMBL4182363 0.87 MAPT (0.43) MEN1KMT2APOLBTP53CYP3A4
SCHEMBL5697823 0.86 MAPT (0.39) POLBNPSR1LMNAMAPTALOX12
SCHEMBL10596738 0.86 CNR2 (0.37) MEN1KMT2ACYP3A4CYP2C9CYP2C19
SCHEMBL1370527 0.84 MAPT (0.44) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL29460366 0.84 MAPT (0.44) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL10594003 0.83 CYP3A4 (0.40) MEN1KMT2APOLBTSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4736027-A COLOR FORMING HILTON DAVIS CHEMICAL CO. (US) 1988-04-05 US claimed
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