SCHEMBL11633643

SCHEMBL11633643

O=C1c2cccc3cccc(c23)C(O)N1CCN1CC=CC(c2ccc(Cl)cc2)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.39
▸ KDM4E B2RXH2 4/20 0.39
▸ HPGD P15428 4/20 0.39
▸ LMNA P02545 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ MDM2 Q00987 4/20 0.36
▸ HTT P42858 1/20 0.36
▸ POLB P06746 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ UBE2N P61088 1/20 0.34
▸ HTR1A P08908 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PPARG P37231 1/20 0.33

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
SCHEMBL11631639 0.91 L3MBTL1 (0.46) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11631327 0.81 L3MBTL1 (0.49) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11631833 0.80 L3MBTL1 (0.44) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11631928 0.80 L3MBTL1 (0.44) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11805397 0.79 DRD2 (0.48) ALDH1A1KDM4EHPGDLMNAMAPT
SCHEMBL11632587 0.77 L3MBTL1 (0.50) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11629224 0.77 DRD2 (0.56) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11629904 0.77 L3MBTL1 (0.47) L3MBTL1ALDH1A1KDM4EHPGDLMNA
SCHEMBL11629801 0.75 L3MBTL1 (0.41) L3MBTL1ALDH1A1HPGDLMNAMAPT
SCHEMBL11634977 0.75 L3MBTL1 (0.47) L3MBTL1ALDH1A1KDM4EHPGDLMNA

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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