SCHEMBL9150735

SCHEMBL9150735

CSc1c(C2CCNCC2)c2ccccc2n1-c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.39
KCNH2 Q12809 4/20 0.38
HTR1A P08908 6/20 0.38
SLC6A2 P23975 6/20 0.38
SLC6A4 P31645 6/20 0.38
SLC6A3 Q01959 6/20 0.38
KHK P50053 3/20 0.37
USP14 P54578 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
NR4A2 P43354 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL9150837 0.79 HTR6 (0.40) RENKCNH2HTR1ASLC6A2SLC6A4
SCHEMBL28216093 0.70 HTR2C (0.44) KCNH2HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL11245466 0.68 SIGMAR1 (0.42) RENUSP14SIGMAR1
SCHEMBL5254443 0.68 CYP11B2 (0.46) KCNH2HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL2565277 0.68 CCR3 (0.61) HTR1ASLC6A2SLC6A4SLC6A3KHK
SCHEMBL29385 0.66 KDM4E (0.67) RENUSP14
SCHEMBL11670374 0.65 HTR6 (0.40) RENUSP14SIGMAR1HTR2AHTR2C
SCHEMBL14540707 0.64 PLAT (0.41) KCNH2HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL9150726 0.64 KCNH2 (0.61) KCNH2
Hydrochloric Acid SCHEMBL31078540 0.63 HTR6 (0.48) HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5457115-A Treating anxiety, depression, sleep disorders, migranes, schizophrenia or Parkinson's disease in humans H. LUNDBECK A/S (DK) 1995-10-10 US disclosed
EP-0465398-B1 Novel indole derivatives LUNDBECK & CO AS H (DK) 1994-12-14 EP disclosed
US-5322851-A Indole derivatives H. LUNDBECK A/S (DK) 1994-06-21 US disclosed
US-5216001-A Central nervous system disorders H. LUNBECK A/S (DK) 1993-06-01 US disclosed