SCHEMBL9023866

SCHEMBL9023866

O=C1c2ccccc2OCCN1CCCCBr

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 6/20 0.46
▸ WDR77 Q9BQA1 6/20 0.46
▸ HTR1A P08908 3/20 0.40
▸ DRD3 P35462 5/20 0.37
▸ DRD2 P14416 3/20 0.37
▸ DRD5 P21918 1/20 0.37
▸ DRD1 P21728 3/20 0.37
▸ KMT2A Q03164 1/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL9024811 0.99 PRMT5 (0.46) PRMT5WDR77HTR1ADRD3DRD2
SCHEMBL13063351 0.86 PKM (0.38) PRMT5WDR77HTR1ADRD3DRD2
SCHEMBL9368923 0.84 PRMT5 (0.47) PRMT5WDR77HTR1ADRD3DRD2
SCHEMBL13438368 0.81 TSHR (0.39) PRMT5WDR77HTR1ADRD3DRD2
SCHEMBL9024164 0.78 SIGMAR1 (0.50) KMT2AHTR7TSHR
SCHEMBL38653482 0.78 PRMT5 (0.51) PRMT5WDR77KMT2APKMTSHR
SCHEMBL31033174 0.78 PRMT5 (0.49) PRMT5WDR77DRD3DRD2KMT2A
SCHEMBL9024576 0.77 SIGMAR1 (0.51) KMT2AHTR7TSHR
SCHEMBL9369658 0.77 DRD3 (0.67) HTR1ADRD3DRD2DRD1HTR7
SCHEMBL12460571 0.76 HRH1 (0.49) PRMT5WDR77KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0463810-B1 Heterocyclic compound and psychopharmaceutical composition containing same SUNTORY LTD (JP) 1996-01-10 — — EP disclosed
EP-0376633-B1 Benzoxazepine derivatives SUNTORY LTD (JP) 1994-10-12 — — EP disclosed
US-5158947-A CONDENSED HETEROCYCLIC COMPOUNDS AND PSYCHOPHARMACEUTICAL COMPOSITION CONTAINING SAME SUNTORY LIMITED (JP) 1992-10-27 — — US disclosed
EP-0463810-A1 Heterocyclic compound and psychopharmaceutical composition containing same SUNTORY LIMITED (JP) 1992-01-02 — — EP disclosed
EP-0376633-A2 Benzoxazepine derivatives SUNTORY LIMITED (JP) 1990-07-04 — — EP disclosed
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