SCHEMBL8623610

SCHEMBL8623610

CCCCCCCCCCCCOC(=O)NCNC(=O)c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 1/20 0.52
ESR1 P03372 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
MAPK1 P28482 1/20 0.52
CYP2C19 P33261 1/20 0.52
NR1H2 P55055 1/20 0.52
RNASEL Q05823 1/20 0.52
ACHE P22303 6/20 0.49
CNR2 P34972 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
HSD17B3 P37058 5/20 0.47
EPHX1 P07099 1/20 0.46

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
SCHEMBL8391807 1.00 SMN1; SMN2 (0.52) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8391809 1.00 SMN1; SMN2 (0.52) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8621112 1.00 SMN1; SMN2 (0.52) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8622624 0.85 SMN1; SMN2 (0.56) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8389809 0.85 SMN1; SMN2 (0.56) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8388534 0.85 SMN1; SMN2 (0.56) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8622146 0.85 SMN1; SMN2 (0.56) SMN1; SMN2TSHRLMNAESR1CYP1A2
SCHEMBL8627331 0.82 NAAA (0.51) SMN1; SMN2LMNAACHENPC1RAB9A
SCHEMBL8622139 0.82 NAAA (0.51) SMN1; SMN2LMNAACHENPC1RAB9A
SCHEMBL8622102 0.82 NAAA (0.51) SMN1; SMN2LMNAACHENPC1RAB9A

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
EP-0648612-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1998-06-10 EP disclosed
US-5498772-A SUBSTRATE WITH HEAT SENSITIVE LAYER AND OPTICAL RECORDING LAYER MITSUBISHI PAPER MILLS LIMITED (JP) 1996-03-12 US disclosed
EP-0648612-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1995-04-19 EP disclosed