SCHEMBL9275071

SCHEMBL9275071

CC(CN1CC(O)C1)C(C)N(C)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.41
▸ P2RX7 Q99572 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ CHRM2 P08172 2/20 0.37
▸ CHRM3 P20309 2/20 0.37
▸ MCHR1 Q99705 2/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NTSR1 P30989 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ KDM2B Q8NHM5 1/20 0.35

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
SCHEMBL9280185 0.89 P2RX7 (0.38) P2RX7USP2ALOX15CHRM2CHRM3
SCHEMBL9281360 0.89 HRH3 (0.45) HRH3P2RX7CHRM2CHRM3MCHR1
SCHEMBL9274530 0.88 HRH3 (0.44) HRH3USP2ALOX15CHRM2CHRM3
SCHEMBL9280860 0.88 HRH3 (0.41) HRH3CHRM2CHRM3OPRK1L3MBTL1
SCHEMBL9103017 0.87 HRH3 (0.43) HRH3P2RX7USP2ALOX15CHRM2
SCHEMBL9103010 0.87 HRH3 (0.43) HRH3P2RX7USP2ALOX15CHRM2
SCHEMBL9107105 0.85 HRH3 (0.40) HRH3P2RX7USP2ALOX15CHRM2
SCHEMBL9103361 0.85 HRH3 (0.40) HRH3P2RX7USP2ALOX15CHRM2
SCHEMBL9105365 0.85 HRH3 (0.41) HRH3P2RX7USP2ALOX15CHRM2
SCHEMBL9105358 0.85 HRH3 (0.41) HRH3P2RX7USP2ALOX15CHRM2

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-2012074469-A1 NEW IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 — — WO disclosed
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