SCHEMBL8340386

SCHEMBL8340386

Cc1nc2cc(F)ccc2n1CCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 5/20 0.57
HTR1A P08908 5/20 0.57
DRD3 P35462 3/20 0.51
P2RX7 Q99572 1/20 0.50
DRD2 P14416 2/20 0.48
HTR2A P28223 1/20 0.48
HRH1 P35367 1/20 0.48
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
KCNH2 Q12809 3/20 0.47
DRD4 P21917 1/20 0.46
MPO P05164 1/20 0.46
SLC6A4 P31645 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL6839501 0.93 HTR1A (0.48) HTR7HTR1AHTR2ASLC6A4
SCHEMBL8336417 0.87 HTR3E (0.53) HTR1AP2RX7SIGMAR1
SCHEMBL7081243 0.86 HTR7 (0.67) HTR7HTR1ADRD3P2RX7DRD2
SCHEMBL15748179 0.86 HTR7 (0.55) HTR7HTR1ADRD3P2RX7DRD2
SCHEMBL8336244 0.83 SIGMAR1 (0.52) HTR1ADRD2SIGMAR1
SCHEMBL8788615 0.80 GRM2 (0.42) HTR7HTR1ADRD3P2RX7DRD2
SCHEMBL8788970 0.79 MCHR1 (0.48) HTR1ADRD3DRD2HTR2ASIGMAR1
SCHEMBL8336401 0.78 PKM (0.47) HTR1ADRD3DRD2HTR2ASLC6A4
SCHEMBL17192201 0.76 KCNH2 (0.64) HTR7HTR1ADRD3P2RX7DRD2
SCHEMBL9053834 0.76 DRD2 (0.50) HTR7HTR1ADRD3DRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5889010-A PSYCHOLOGICAL DISORDERS; UROGENITAL DISORDERS; COGNITION ACTIVATORS; NERVOUS SYSTEM DISORDERS; VISION DEFECTS; CONGESTIVE HEART FAILURE; DRUG ABRUSE; PARKINSON'S DISEASE;ANTIINFLAMMATORY AGENTS; ANTIALLERGENS PFIZER INC. (US) 1999-03-30 US disclosed
EP-0775118-A1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER INC. (US) 1997-05-28 EP disclosed
WO-1996004250-A1 BENZIMIDAZOLE DERIVATIVES HAVING DOPAMINERGIC ACTIVITY PFIZER INC. (US) 1996-02-15 WO disclosed