SCHEMBL11633475

SCHEMBL11633475

O=C1c2cccc3cccc(c23)C(O)N1CCN1CCC(O)(c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ DRD2 P14416 6/20 0.43
▸ TACR1 P25103 1/20 0.40
▸ DRD4 P21917 4/20 0.39
▸ DRD3 P35462 4/20 0.39
▸ CCR1 P32246 4/20 0.39
▸ HTR1A P08908 2/20 0.39
▸ HTR2A P28223 2/20 0.39
▸ HTR7 P34969 2/20 0.39
▸ HTR6 P50406 2/20 0.39
▸ OPRM1 P35372 4/20 0.37
▸ OPRL1 P41146 2/20 0.37
▸ NOS2 P35228 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ DRD1 P21728 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
SCHEMBL11634977 0.90 L3MBTL1 (0.47) L3MBTL1DRD2CCR1OPRM1OPRL1
SCHEMBL11634992 0.86 L3MBTL1 (0.53) L3MBTL1DRD2DRD4DRD3HTR7
SCHEMBL11741206 0.85 L3MBTL1 (0.46) L3MBTL1DRD2DRD3HTR1AHTR2A
SCHEMBL11629858 0.84 L3MBTL1 (0.44) L3MBTL1OPRM1OPRL1KDM4ELMNA
SCHEMBL11630316 0.84 OPRM1 (0.52) L3MBTL1DRD2DRD4DRD3CCR1
SCHEMBL11629569 0.83 L3MBTL1 (0.44) L3MBTL1DRD2CCR1HTR1AHTR2A
SCHEMBL11633185 0.81 L3MBTL1 (0.47) L3MBTL1DRD2TACR1DRD4DRD3
SCHEMBL11629536 0.81 SIGMAR1 (0.46) L3MBTL1DRD2CCR1HTR7OPRL1
SCHEMBL11629977 0.80 SIGMAR1 (0.46) L3MBTL1DRD2CCR1HTR1AHTR2A
SCHEMBL11630996 0.80 SIGMAR1 (0.46) L3MBTL1DRD2CCR1HTR1AHTR2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4077958-A ANTIDEPRESSANTS E. R. SQUIBB & SONS, INC. (US) 1978-03-07 — — US disclosed
US-4007191-A ANTIDEPRESSANT E. R. SQUIBB & SONS, INC. (US) 1977-02-08 — — US disclosed
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