SCHEMBL9053157

SCHEMBL9053157

CC(CNCCO)C[C@@H](C)O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 2/20 0.36
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL9407525 0.83 TSHR (0.33)
SCHEMBL1425004 0.80
SCHEMBL17941722 0.80
SCHEMBL3509339 0.80
SCHEMBL5568955 0.78 TDP1 (0.31) TDP1
Hydrochloric Acid SCHEMBL8391715 0.78
SCHEMBL11089087 0.78
SCHEMBL27572031 0.77
SCHEMBL1634844 0.76
SCHEMBL6865618 0.76 KMT2A (0.41) TDP1

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
WO-1996038465-A1 ALKYL 2β-MORPHOLINO-ANDROSTANE DERIVATIVES AKZO NOBEL N.V. (NL) 1996-12-05 WO disclosed