SCHEMBL22255218

SCHEMBL22255218

CCN(Cc1ccc(C(C)C)cc1)[C@H]1CC[C@H](N)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 6/20 0.41
▸ CNR1 P21554 4/20 0.41
▸ DPP4 P27487 1/20 0.40
▸ DPP8 Q6V1X1 1/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ GRIN2B Q13224 1/20 0.39
▸ SLC6A2 P23975 5/20 0.39
▸ SLC6A4 P31645 5/20 0.39
▸ LTA4H P09960 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ PYCR1 P32322 1/20 0.38
▸ IDO1 P14902 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ MAPT P10636 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
SCHEMBL22255224 1.00 CNR2 (0.41) CNR2CNR1DPP4DPP8DPP9
SCHEMBL22255181 0.85 SLC6A2 (0.39) CNR2CNR1SLC6A2SLC6A4SLC6A3
SCHEMBL25541757 0.79 HDAC3 (0.42) DPP4DPP8DPP9DPP7GRIN2B
SCHEMBL25541760 0.79 HDAC3 (0.42) DPP4DPP8DPP9DPP7GRIN2B
SCHEMBL22255223 0.77 HRH3 (0.43) CNR2CNR1SLC6A2SLC6A4SLC6A3
SCHEMBL22255215 0.73 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3
SCHEMBL3371525 0.72 GRIN2B (0.63) CNR2DPP4DPP8DPP9DPP7
SCHEMBL25541754 0.71 HDAC3 (0.41) DPP4DPP8DPP9DPP7GRIN2B
SCHEMBL24220857 0.71 — —
SCHEMBL3490832 0.71 — —

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-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 — — WO disclosed
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