SCHEMBL8626758

SCHEMBL8626758

CCCCCCCCCCCC(=O)N(N)C(=O)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.59
ESR1 P03372 8/20 0.47
ESR2 Q92731 5/20 0.47
LMNA P02545 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
NR1H2 P55055 1/20 0.43
RNASEL Q05823 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PSMB11 A5LHX3 1/20 0.42
PSMA7 O14818 1/20 0.42
PSMB1 P20618 1/20 0.42
PSMA1 P25786 1/20 0.42
PSMA2 P25787 1/20 0.42
PSMA3 P25788 1/20 0.42
PSMA4 P25789 1/20 0.42
PSMB8 P28062 1/20 0.42

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
SCHEMBL8391661 1.00 HSD17B3 (0.59) HSD17B3ESR1ESR2LMNACYP1A2
SCHEMBL8390621 1.00 HSD17B3 (0.59) HSD17B3ESR1ESR2LMNACYP1A2
SCHEMBL8391805 1.00 HSD17B3 (0.59) HSD17B3ESR1ESR2LMNACYP1A2
SCHEMBL11324137 0.94 HSD17B3 (0.49) HSD17B3
SCHEMBL11313632 0.94 HSD17B3 (0.49) HSD17B3
SCHEMBL11679790 0.94 HSD17B3 (0.49) HSD17B3
SCHEMBL11318345 0.94 HSD17B3 (0.49) HSD17B3
SCHEMBL11325678 0.94 HSD17B3 (0.49) HSD17B3
SCHEMBL11325230 0.87 HDAC3 (0.47) HSD17B3ALDH1A1EGFR
SCHEMBL3125344 0.86 CES2 (0.55) LMNA

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