SCHEMBL7489582

SCHEMBL7489582

[N]Cc1cc(Cl)ccc1OCc1cccnc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 1/20 0.57
▸ HTR1A P08908 2/20 0.52
▸ DRD2 P14416 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ PTGER1 P34995 5/20 0.49
▸ LRRK2 Q5S007 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ IKBKB O14920 1/20 0.43

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
SCHEMBL6214597 0.86 SLC6A4 (0.57) SLC6A4HTR1ADRD2MEN1HTT
SCHEMBL30557975 0.81 PTGER1 (0.54) SLC6A4PTGER1
Picolamine SCHEMBL29071785 0.79 MEN1 (0.53) SLC6A4HTR1ADRD2MEN1HTT
SCHEMBL31252511 0.79 MEN1 (0.75) MEN1HTTKMT2APTGER1LRRK2
SCHEMBL6216769 0.78 GRM5 (0.54) SLC6A4HTR1ADRD2MEN1HTT
SCHEMBL30335622 0.77 SLC6A4 (0.56) SLC6A4HTR1ADRD2MEN1HTT
SCHEMBL14008090 0.75 PTGER1 (0.66) MEN1KMT2APTGER1LRRK2POLB
SCHEMBL4924916 0.74 PTGER1 (0.77) MEN1KMT2APTGER1
SCHEMBL8881389 0.73 HTT (0.62) SLC6A4MEN1HTTKMT2AALDH1A1
SCHEMBL2283761 0.73 SLC6A4 (1.00) SLC6A4

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
EP-1216257-A1 COMPOUNDS FOR THE TREATMENT OF ISCHEMIA Pfizer Products Inc. (US) 2002-06-26 — — EP disclosed
WO-2001023399-A1 COMPOUNDS FOR THE TREATMENT OF ISCHEMIA PFIZER PRODUCTS INC. (US) 2001-04-05 — — WO disclosed
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