SCHEMBL11635382

SCHEMBL11635382

O=C1c2cccc3cccc(c23)C(O)N1CCN1CCC(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ GRM2 Q14416 3/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ HTR1A P08908 2/20 0.41
▸ HTR2A P28223 2/20 0.41
▸ HTR7 P34969 2/20 0.41
▸ HTR6 P50406 2/20 0.41
▸ CHRM4 P08173 1/20 0.40
▸ USP5 P45974 1/20 0.39
▸ MCHR1 Q99705 1/20 0.38
▸ HTR2C P28335 2/20 0.38
▸ TRPV6 Q9H1D0 1/20 0.38
▸ KDM4A O75164 1/20 0.38
▸ KDM4B O94953 1/20 0.38
▸ KDM5C P41229 1/20 0.38
▸ KDM5B Q9UGL1 1/20 0.38
▸ CCR5 P51681 2/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37

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
SCHEMBL11631389 0.86 L3MBTL1 (0.55) DRD2L3MBTL1HTR1A
SCHEMBL11632940 0.86 L3MBTL1 (0.47) DRD2L3MBTL1DRD4MCHR1
SCHEMBL11635491 0.84 HTR7 (0.59) DRD2HTR1AHTR2AHTR7HTR6
SCHEMBL11631902 0.84 L3MBTL1 (0.49) DRD2L3MBTL1HTR1AHTR2AHTR7
SCHEMBL11633185 0.83 L3MBTL1 (0.47) DRD2L3MBTL1DRD4HTR1AHTR2A
SCHEMBL11630316 0.82 OPRM1 (0.52) DRD2L3MBTL1DRD4CHRM4TRPV6
SCHEMBL11631327 0.82 L3MBTL1 (0.49) DRD2L3MBTL1HTR1AHTR2AHTR7
SCHEMBL11633522 0.81 L3MBTL1 (0.47) DRD2L3MBTL1DRD4HTR7CHRM4
SCHEMBL11632747 0.81 L3MBTL1 (0.47) L3MBTL1HTR7
SCHEMBL11813026 0.80 DRD2 (0.58) DRD2GRM2DRD4HTR1AHTR2A

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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