SCHEMBL6327906

SCHEMBL6327906

COc1ccc(N)cc1C(=O)c1ccccc1OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPK14 Q16539 2/20 0.46
MAPK13 O15264 1/20 0.46
MAPK12 P53778 1/20 0.46
MAPK11 Q15759 1/20 0.46
RORB Q92753 5/20 0.44
RORC P51449 2/20 0.44
ELANE P08246 1/20 0.43
CTSD P07339 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KCNK3 O14649 1/20 0.41
KCNK9 Q9NPC2 1/20 0.41
STS P08842 1/20 0.41
CNR2 P34972 1/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL6652813 0.79 MAPK14 (0.64) LMNAALOX15HSD17B10MAPK14MAPK13
SCHEMBL6652431 0.79 ELANE (0.51) ELANEALDH1A1STSHTTKMT2A
SCHEMBL4636514 0.76 ALDH1A1 (0.53) ALOX15HSD17B10ALDH1A1MEN1KMT2A
SCHEMBL322168 0.75 CTSD (0.62) LMNAALOX15HSD17B10ELANECTSD
SCHEMBL29658169 0.75 CTSD (0.62) LMNAALOX15HSD17B10ELANECTSD
SCHEMBL10713056 0.75 RORC (0.56) LMNARORBRORCALDH1A1MEN1
SCHEMBL596796 0.74 ALDH1A1 (0.39) ALOX15HSD17B10ALDH1A1MEN1KMT2A
SCHEMBL27789892 0.74 CTSD (0.60) LMNAALOX15HSD17B10ELANECTSD
SCHEMBL6656065 0.73 STS (0.64) LMNAALOX15HSD17B10MAPK14CTSD
SCHEMBL3818697 0.73 KDM4E (0.59) LMNAALOX15HSD17B10MAPK14MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6960553-B2 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD. (JP) 2005-11-01 US disclosed
US-20030186810-A1 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD. 2003-10-02 US disclosed