SCHEMBL11634429

SCHEMBL11634429

CCCSc1ccccc1N1CCN(CCN2C(=O)c3cccc4cccc(c34)C2O)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ DRD2 P14416 11/20 0.42
▸ HTR7 P34969 10/20 0.42
▸ HTR1A P08908 9/20 0.42
▸ HTR2A P28223 9/20 0.42
▸ HTR6 P50406 9/20 0.42
▸ DRD3 P35462 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL11628968 0.83 DRD2 (0.58) L3MBTL1DRD2HTR7HTR1AHTR2A
SCHEMBL11636284 0.81 DRD2 (0.63) DRD2HTR7HTR1AHTR2AHTR6
SCHEMBL11631804 0.80 L3MBTL1 (0.59) L3MBTL1DRD2HTR7HTR1AHTR2A
SCHEMBL11634432 0.79 L3MBTL1 (0.44) L3MBTL1DRD2HTR7HTR1AHTR2A
SCHEMBL11629079 0.78 L3MBTL1 (0.51) L3MBTL1DRD2HTR7HTR1AHTR2A
SCHEMBL11632015 0.76 HTR7 (0.60) L3MBTL1DRD2HTR7HTR1AHTR2A
SCHEMBL11629077 0.76 L3MBTL1 (0.56) L3MBTL1KDM4E
SCHEMBL11635081 0.76 L3MBTL1 (0.56) L3MBTL1
SCHEMBL11630691 0.75 KDM4E (0.61) L3MBTL1DRD2HTR7HTR1AHTR2A
SCHEMBL11629224 0.75 DRD2 (0.56) L3MBTL1DRD2HTR7HTR1AHTR2A

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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