SCHEMBL11632135

SCHEMBL11632135

O=C1c2cccc3cccc(c23)C(O)N1CCN1CC=C(CCc2ccccc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HTR1A P08908 2/20 0.38
▸ GRIN1 Q05586 2/20 0.36
▸ GRIN2B Q13224 2/20 0.36
▸ SIGMAR1 Q99720 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ DRD1 P21728 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ PARP1 P09874 1/20 0.34

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
SCHEMBL11634736 0.94 L3MBTL1 (0.44) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11633446 0.94 L3MBTL1 (0.44) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11629570 0.92 L3MBTL1 (0.41) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11631767 0.91 L3MBTL1 (0.47) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11633934 0.85 L3MBTL1 (0.39) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11633966 0.84 HTR1A (0.56) L3MBTL1HTR1ASIGMAR1PARP1
SCHEMBL11629077 0.84 L3MBTL1 (0.56) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11636616 0.83 L3MBTL1 (0.42) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11633867 0.82 L3MBTL1 (0.54) L3MBTL1ALDH1A1MAPTGAAKDM4E
SCHEMBL11744576 0.81 L3MBTL1 (0.53) L3MBTL1ALDH1A1MAPTGAAKDM4E

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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