SCHEMBL18653049

SCHEMBL18653049

CN1C(N)CC2CCCC21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.35
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ CHRM3 P20309 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
SCHEMBL8299438 0.95 CYP2D6 (0.31) MAPK1
SCHEMBL20923608 0.80 CYP2D6 (0.36) MAPK1CHRM2CHRM4CHRM1CHRM3
SCHEMBL23346703 0.79 MAPK1 (0.32) MAPK1
SCHEMBL11083871 0.79 MAPK1 (0.32) MAPK1
SCHEMBL20202824 0.75 CYP2D6 (0.41) MAPK1CHRM2CHRM4CHRM1CHRM3
SCHEMBL812020 0.74 ACHE (0.33) MAPK1CHRM2CHRM4CHRM1CHRM3
SCHEMBL20707079 0.74 ACHE (0.33) MAPK1CHRM2CHRM4CHRM1CHRM3
SCHEMBL16298355 0.74 ACHE (0.33) MAPK1CHRM2CHRM4CHRM1CHRM3
SCHEMBL14877546 0.74 ACHE (0.33) MAPK1CHRM2CHRM4CHRM1CHRM3
SCHEMBL15832377 0.74 ACHE (0.33) MAPK1CHRM2CHRM4CHRM1CHRM3

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
EP-2678334-B1 ANTI-VIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2017-03-22 — — EP disclosed
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