SCHEMBL22255196

SCHEMBL22255196

Cc1ccc(CC(C)N(C)C2CCC(N)C2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 5/20 0.35
▸ SLC6A2 P23975 2/20 0.35
▸ OPRK1 P41145 2/20 0.31
▸ ADRA2B P18089 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ DPP4 P27487 1/20 0.30
▸ FAP Q12884 1/20 0.30
▸ DPP8 Q6V1X1 1/20 0.30
▸ DPP9 Q86TI2 1/20 0.30
▸ DPP7 Q9UHL4 1/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ OPRD1 P41143 1/20 0.30
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 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
SCHEMBL22254882 0.89 SLC6A4 (0.33) SLC6A4SLC6A2OPRK1ADRA2BADRA2C
SCHEMBL25541883 0.85 TP53 (0.39) SLC6A4KCNH2DPP4FAPDPP8
SCHEMBL25531098 0.85 TP53 (0.39) SLC6A4KCNH2DPP4FAPDPP8
SCHEMBL25541902 0.76 TP53 (0.41) SLC6A4ADRA2BADRA2CADRA1AKCNH2
SCHEMBL25532170 0.74 ROCK2 (0.37) —
SCHEMBL25532177 0.74 ROCK2 (0.37) —
SCHEMBL22255182 0.72 SLC6A4 (0.38) SLC6A4SLC6A2OPRK1ADRA2BADRA2C
SCHEMBL22255190 0.72 SLC6A4 (0.38) SLC6A4SLC6A2OPRK1ADRA2BADRA2C
SCHEMBL22254879 0.70 SLC6A4 (0.52) SLC6A4
SCHEMBL22254877 0.70 SLC6A4 (0.52) SLC6A4

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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