SCHEMBL11322317

SCHEMBL11322317

CCCCNc1ccccc1CCC1CCCCN1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 1/20 0.55
▸ HRH2 P25021 1/20 0.55
▸ HTR2A P28223 1/20 0.55
▸ HTR2C P28335 1/20 0.55
▸ OPRK1 P41145 1/20 0.55
▸ HTR2B P41595 1/20 0.55
▸ KCNH2 Q12809 1/20 0.55
▸ ADRA2A P08913 2/20 0.44
▸ METAP2 P50579 1/20 0.41
▸ ACP1 P24666 2/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ SLC18A2 Q05940 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ ADRA1B P35368 1/20 0.39
▸ CHRM3 P20309 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
SCHEMBL11330307 0.88 DRD1 (0.59) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL10134845 0.85 DRD1 (0.49) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11175765 0.82 DRD1 (0.61) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11321446 0.82 DRD1 (0.56) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11422277 0.81 DRD1 (0.55) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL13994801 0.81 DRD1 (0.55) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11332620 0.81 DRD1 (0.66) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11322085 0.80 DRD1 (0.59) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11322942 0.80 KCNH2 (0.44) DRD1HRH2HTR2AHTR2COPRK1
SCHEMBL11327257 0.80 DRD1 (0.59) DRD1HRH2HTR2AHTR2COPRK1

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
US-RE30812-E ANTIARRHTHMIA AGENTS MEAD JOHNSON & COMPANY (US) 1981-12-01 — — US disclosed
US-RE30811-E SEROTONIN ANTAGONISTS, ANTIARRHYTHMIA AGENTS MEAD JOHNSON & COMPANY (US) 1981-12-01 — — US disclosed
US-4064254-A ANTIARRHYTHMIC AND ANTISEROTONINE AGENTS MEAD JOHNSON & COMPANY (US) 1977-12-20 — — US disclosed
US-4000143-A ANTIARRHYTHMIC AND ANTISEROTONIN AGENTS MEAD JOHNSON & COMPANY (US) 1976-12-28 — — US disclosed
US-3931195-A ANTIARRHYTHMIA, ANTISEROTONIN MEAD JOHNSON & COMPANY (US) 1976-01-06 — — US disclosed
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