SCHEMBL11064469

SCHEMBL11064469

CCC(=COCCCCCCOC=C(CC)CC)CC

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.33
GBA1 P04062 1/20 0.32
ACHE P22303 6/20 0.30
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
SCHEMBL4426715 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4431935 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4430759 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4427552 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4430261 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4429473 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4429493 0.93 NAAA (0.43) NAAAGBA1MEN1THRBHTT
SCHEMBL4428248 0.90 NAAA (0.40) NAAAGBA1MEN1THRBHTT
SCHEMBL4428294 0.87 ATM (0.38) NAAAGBA1ACHE
SCHEMBL11062213 0.84 NAAA (0.36) NAAAGBA1ACHEMEN1THRB

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-4481321-A Process for increasing the ozone-resistance of a rubber with enol ethers BAYER AKTIENGESELLSCHAFT (DE) 1984-11-06 US disclosed