SCHEMBL11630735

SCHEMBL11630735

O=C1c2cccc3cccc(c23)C(O)N1CCN1CC=C(c2ccc(F)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 7/20 0.48
▸ SIGMAR1 Q99720 5/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HTR2A P28223 1/20 0.42
▸ HTR7 P34969 1/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ PARP1 P09874 3/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ PARP2 Q9UGN5 1/20 0.41

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
SCHEMBL11633966 0.91 HTR1A (0.56) HTR1ASIGMAR1L3MBTL1PARP1
SCHEMBL11748179 0.87 HTR1A (0.46) HTR1ASIGMAR1L3MBTL1HTR2AHTR7
SCHEMBL11633559 0.87 HTR1A (0.42) HTR1ASIGMAR1L3MBTL1KDM4EMAPT
SCHEMBL11632573 0.87 HTR1A (0.49) HTR1ASIGMAR1L3MBTL1HTR7PARP1
SCHEMBL11632855 0.86 HTR7 (0.53) HTR1AL3MBTL1HTR2AHTR7HTR6
SCHEMBL11629570 0.85 L3MBTL1 (0.41) HTR1AL3MBTL1KDM4EALDH1A1LMNA
SCHEMBL11632426 0.85 L3MBTL1 (0.47) HTR1AL3MBTL1ALDH1A1DRD2
SCHEMBL11632779 0.85 HTR1A (0.50) HTR1ASIGMAR1HTR7PARP1
SCHEMBL11633300 0.85 HTR1A (0.50) HTR1ASIGMAR1HTR7PARP1
SCHEMBL11632713 0.85 L3MBTL1 (0.47) HTR1ASIGMAR1L3MBTL1HTR2AHTR7

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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