SCHEMBL9863363

SCHEMBL9863363

CCCC(O)C1(C2=CCCCC2)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL28699649 0.68 MEN1 (0.35) HCAR2MEN1KMT2A
SCHEMBL28122000 0.68 SLC6A4 (0.39)
SCHEMBL28696460 0.65 MEN1 (0.41) HCAR2MEN1KMT2A
SCHEMBL793523 0.65 HCAR2 (0.35) HCAR2MEN1KMT2A
SCHEMBL4426108 0.65 HCAR2 (0.35) HCAR2MEN1KMT2A
SCHEMBL10378542 0.65 IDO1 (0.36)
SCHEMBL9751819 0.65 CNR2 (0.40) MEN1KMT2A
SCHEMBL8964887 0.65
Water SCHEMBL28928282 0.64 HCAR2 (0.37) HCAR2MEN1KMT2A
SCHEMBL11981890 0.63 IDO1 (0.31)

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-5069756-A Separation of cyclohexane from cyclohexene by azeotropic or extractive distillation Berg, Lloyd (US) 1991-12-03 US disclosed