SCHEMBL12818985

SCHEMBL12818985

CCCOCCOCCOCCOCCOCCC(N)N

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.30
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL712012 1.00 HSD17B10 (0.37) HSD17B10TDP1MEN1THRBHTT
SCHEMBL17262666 1.00 HSD17B10 (0.37) HSD17B10TDP1MEN1THRBHTT
SCHEMBL1274341 1.00 HSD17B10 (0.37) HSD17B10TDP1MEN1THRBHTT
SCHEMBL1342489 0.97
SCHEMBL10766116 0.90 TSHR (0.36) HSD17B10MEN1THRBHTTKMT2A
SCHEMBL1274298 0.90 HTT (0.39) HSD17B10MEN1THRBHTTKMT2A
SCHEMBL6659201 0.88 HTT (0.42) HSD17B10TDP1MEN1THRBHTT
SCHEMBL5178951 0.88 HTT (0.42) HSD17B10TDP1MEN1THRBHTT
SCHEMBL17262664 0.88 HTT (0.42) HSD17B10TDP1MEN1THRBHTT
SCHEMBL2410543 0.85 HTT (0.37) HSD17B10MEN1THRBHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024086501-A1 DELIVERY PARTICLES BASED ON AMINE-THIOL-ENE CONJUGATES AND DERIVATIVES ENCAPSYS, LLC (US) 2024-04-25 WO disclosed
EP-2879675-A1 COMPOUNDS AND METHODS FOR TARGETING HSP90 Duke University (US) 2015-06-10 EP disclosed
WO-2014025395-A1 COMPOUNDS AND METHODS FOR TARGETING HSP90 DUKE UNIVERSITY (US) 2014-02-13 WO disclosed
EP-2691403-A1 NEW BORANOPHOSPHATE ANALOGUES OF CYCLIC NUCLEOTIDES BIOLOG Life Science Institute Forschungslabor Und Biochemica-Vertrieb GmbH (DE) 2014-02-05 EP disclosed
WO-2012130829-A1 NEW BORANOPHOSPHATE ANALOGUES OF CYCLIC NUCLEOTIDES BIOLOG LIFE SCIENCE INSTITUTE FORSCHUNGSLABOR UND BIOCHEMICA-VERTRIEB GMBH (DE) 2012-10-04 WO disclosed