SCHEMBL11843293

SCHEMBL11843293

COc1ccc2c(c1)C(c1ccccc1)OC21CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.44
▸ HTR2C P28335 4/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ OPRD1 P41143 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ CYP19A1 P11511 2/20 0.38
▸ KDM1A O60341 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ TACR1 P25103 1/20 0.36

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
SCHEMBL11684159 0.90 SIGMAR1 (0.44) SIGMAR1HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL11853705 0.85 SIGMAR1 (0.49) SIGMAR1OPRD1KCNH2KDM1AMAOA
SCHEMBL11782410 0.81 DRD1 (0.44) SIGMAR1HTR2AOPRD1KCNH2
SCHEMBL11682880 0.81 OPRD1 (0.41) SIGMAR1SLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL29705809 0.80 OPRD1 (0.50) SIGMAR1OPRD1KCNH2
SCHEMBL4363631 0.80 OPRD1 (0.50) SIGMAR1OPRD1KCNH2
SCHEMBL11853721 0.78 PRCP (0.42) SIGMAR1SLC6A2SLC6A4SLC6A3OPRD1
SCHEMBL11883509 0.78 PRCP (0.48) —
SCHEMBL11739762 0.78 SIGMAR1 (0.37) SIGMAR1HTR2CSLC6A2SLC6A3HTR2A
SCHEMBL11680301 0.74 OPRD1 (0.43) SIGMAR1SLC6A2SLC6A4SLC6A3OPRD1

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-3996354-A 1,3-Dihydro-1'-dimethylphosphinylalkyl-3-phenylspiro(isobenzofuran)s AMERICAN HOECHST CORPORATION (US) 1976-12-07 — — US disclosed
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