SCHEMBL29320555

SCHEMBL29320555

CCNC(C)COCCOC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL12161296 0.87 TDP1 (0.42)
SCHEMBL12072033 0.84
SCHEMBL18331589 0.84
SCHEMBL13798596 0.84
SCHEMBL5796790 0.78 HSD17B10 (0.32) HSD17B10SIGMAR1
SCHEMBL29320564 0.77 POLB (0.44) HSD17B10KDM4ECYP2D6
SCHEMBL15459790 0.77 HSD17B10 (0.30) HSD17B10
SCHEMBL18898664 0.77 KDM4E (0.34) HSD17B10KDM4ESIGMAR1CYP2D6
SCHEMBL15489273 0.76 POLB (0.46) HSD17B10KDM4ECYP2D6
SCHEMBL29321846 0.76 IDH1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228853-A1 TEXTILE TEMPERATURE REGULATING AGENTS DEVAN CHEMICALS NV (BE) 2024-07-11 US disclosed