SCHEMBL11744846

SCHEMBL11744846

O=C1c2cccc3cccc(c23)C(O)N1CCN1CCC(O)(Cc2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ AVPR1A P37288 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 2/20 0.38
▸ SLC6A2 P23975 2/20 0.38
▸ SLC6A4 P31645 2/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ OPRM1 P35372 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ OPRL1 P41146 1/20 0.37
▸ GRIN2D O15399 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
SCHEMBL11630749 0.91 L3MBTL1 (0.50) L3MBTL1ALDH1A1MAPTGAALMNA
SCHEMBL11631967 0.89 L3MBTL1 (0.48) L3MBTL1ALDH1A1MAPTGAALMNA
SCHEMBL11632571 0.88 L3MBTL1 (0.43) L3MBTL1ALDH1A1MAPTLMNAHTT
SCHEMBL11630716 0.87 RAD52 (0.43) L3MBTL1ALDH1A1GAALMNAKDM4E
SCHEMBL11741206 0.87 L3MBTL1 (0.46) L3MBTL1ALDH1A1MAPTGAASLC6A2
SCHEMBL11634992 0.86 L3MBTL1 (0.53) L3MBTL1ALDH1A1MAPTGAALMNA
SCHEMBL11629077 0.84 L3MBTL1 (0.56) L3MBTL1ALDH1A1MAPTGAALMNA
SCHEMBL11635081 0.84 L3MBTL1 (0.56) L3MBTL1ALDH1A1MAPTGAALMNA
SCHEMBL11634610 0.83 L3MBTL1 (0.45) L3MBTL1ALDH1A1MAPTSLC6A2SLC6A4
SCHEMBL11633867 0.82 L3MBTL1 (0.54) L3MBTL1ALDH1A1MAPTGAALMNA

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
US-4007191-A ANTIDEPRESSANT E. R. SQUIBB & SONS, INC. (US) 1977-02-08 — — US disclosed
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