SCHEMBL16186136

SCHEMBL16186136

COc1ccc(C(=O)c2ccc(Oc3cccc(C)c3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.58
HSD17B2 P37059 2/20 0.58
RAB9A P51151 2/20 0.55
GAA P10253 2/20 0.55
NPC1 O15118 1/20 0.55
TP53 P04637 1/20 0.55
NFKB1 P19838 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ACHE P22303 1/20 0.55
ALDH1A1 P00352 2/20 0.54
STS P08842 1/20 0.52
LMNA P02545 2/20 0.51
SRD5A2 P31213 1/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL14159536 0.94 HSD17B1 (0.64) HSD17B1HSD17B2ALDH1A1LMNASRD5A2
SCHEMBL14030885 0.91 MMP13 (0.56) HSD17B1HSD17B2RAB9AGAASMN1; SMN2
SCHEMBL13374185 0.88 MMP13 (0.60) HSD17B1HSD17B2RAB9ANPC1TP53
SCHEMBL8901914 0.88 MMP13 (0.60) HSD17B1HSD17B2RAB9ANPC1TP53
SCHEMBL13026418 0.88 MMP13 (0.60) HSD17B1HSD17B2RAB9ANPC1TP53
SCHEMBL23771947 0.88 HSD17B1 (0.58) HSD17B1HSD17B2SMN1; SMN2ALDH1A1STS
SCHEMBL14277023 0.87 STS (0.48) HSD17B1HSD17B2RAB9AGAANPC1
SCHEMBL16378706 0.87 MTNR1B (0.62) HSD17B1HSD17B2SMN1; SMN2STSSRD5A2
SCHEMBL3294529 0.87 ACHE (0.72) HSD17B1HSD17B2GAARELASMN1; SMN2
SCHEMBL30358265 0.87 ACHE (0.72) HSD17B1HSD17B2GAARELASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3426741-B1 POLYARYLETHER KETONE COMPOSITIONS AND METHOD OF COATING A METAL SURFACE SOLVAY SPECIALTY POLYMERS USA (US) 2020-10-21 EP disclosed
US-10808143-B2 Polyarylether ketone compositions and method of coating a metal surface SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2020-10-20 US disclosed
US-20190031908-A1 POLYARYLETHER KETONE COMPOSITIONS AND METHOD OF COATING A METAL SURFACE SOLVAY USA INC. 2019-01-31 US disclosed
WO-2017153290-A1 POLYARYLETHER KETONE COMPOSITIONS AND METHOD OF COATING A METAL SURFACE SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2017-09-14 WO disclosed
US-9109075-B2 Cross-linked organic polymers for use as elastomers in high temperature applications Delsper LP (US) 2015-08-18 US disclosed
US-20140316079-A1 Cross-Linked Organic Polymers For Use as Elastomers in High Temperature Applications Delsper LP 2014-10-23 US disclosed