SCHEMBL8908367

SCHEMBL8908367

O=C(c1ccccc1)N1CCC(O)CC1CF

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.45
▸ TACR1 P25103 5/20 0.42
▸ GRM5 P41594 1/20 0.42
▸ ACHE P22303 1/20 0.41
▸ ABCB1 P08183 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ HCRTR1 O43613 1/20 0.39
▸ HCRTR2 O43614 1/20 0.39
▸ SLC18A3 Q16572 1/20 0.39
▸ EPHX1 P07099 1/20 0.38
▸ L3MBTL3 Q96JM7 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL4932563 0.81 SPHK2 (0.50) L3MBTL1HCRTR1HCRTR2L3MBTL3HPGD
SCHEMBL27504223 0.78 ACHE (0.51) PIK3CDGRM5ACHEL3MBTL1HPGD
SCHEMBL9112230 0.73 TACR1 (0.78) TACR1
SCHEMBL9113036 0.73 TACR1 (0.78) TACR1
SCHEMBL7864829 0.73 TACR1 (0.71) TACR1
SCHEMBL7864826 0.73 TACR1 (0.71) TACR1
SCHEMBL7864902 0.73 TACR1 (0.71) TACR1
SCHEMBL27946634 0.73 ABCB1 (0.62) TACR1ABCB1
SCHEMBL22669113 0.71 GBA1 (0.50) —
SCHEMBL13722390 0.71 TACR1 (0.46) TACR1ABCB1

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-1997040010-A1 HALOGENATED NAPHTHYL METHOXY PIPERIDINES FOR MAPPING SEROTONIN TRANSPORTER SITES EMORY UNIVERSITY (US) 1997-10-30 — — WO disclosed
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