SCHEMBL8389809

SCHEMBL8389809

CCCCCCCCCCCCOC(=O)NNC(=O)c1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
ESR1 P03372 2/20 0.56
TSHR P16473 2/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
MAPK1 P28482 1/20 0.56
CYP2C19 P33261 1/20 0.56
NR1H2 P55055 1/20 0.56
RNASEL Q05823 1/20 0.56
HSD17B3 P37058 6/20 0.50
EPHX1 P07099 1/20 0.50
GAA P10253 1/20 0.49
ALDH1A1 P00352 4/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
NR5A1 Q13285 1/20 0.49
TDP1 Q9NUW8 2/20 0.48
CHRM1 P11229 1/20 0.47

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
SCHEMBL8388534 1.00 SMN1; SMN2 (0.56) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8622146 1.00 SMN1; SMN2 (0.56) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8622624 1.00 SMN1; SMN2 (0.56) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8391807 0.85 SMN1; SMN2 (0.52) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8623610 0.85 SMN1; SMN2 (0.52) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8621112 0.85 SMN1; SMN2 (0.52) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8391809 0.85 SMN1; SMN2 (0.52) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8391789 0.83 SMN1; SMN2 (0.61) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL8756726 0.83 SMN1; SMN2 (0.61) SMN1; SMN2ESR1TSHRLMNACYP1A2
SCHEMBL12021527 0.82 SMN1; SMN2 (0.52) SMN1; SMN2ESR1TSHRLMNACYP1A2

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-6004899-A SURFACE TREATED WITH SILANE, TITANATE, AND/OR ALUMINUM COUPLING AGENT; PIGMENT; ERASIBILITY MITSUBISHI PAPER MILLS LIMITED (JP) 1999-12-21 US disclosed
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