SCHEMBL8844155

SCHEMBL8844155

Nc1cccnc1C1CCNC1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.39
SLC6A2 P23975 4/20 0.39
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 2/20 0.39
HTR3A P46098 1/20 0.39
USP25 Q9UHP3 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
Methane SCHEMBL9482819 0.98 HTR1A (0.38) HTR1ASLC6A2SLC6A4SLC6A3HTR3A
Hydrochloric Acid SCHEMBL22031737 0.88 HTR1A (0.43) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL30421966 0.84 HTR3A (0.33) HTR1ASLC6A2SLC6A4SLC6A3HTR3A
SCHEMBL435683 0.80 BTK (0.39) HTR3AUSP25
SCHEMBL29229133 0.80 OPRM1 (0.41) HTR1ASLC6A2SLC6A4SLC6A3HTR3A
SCHEMBL23362965 0.80 OPRL1 (0.38)
SCHEMBL31703523 0.80 OPRL1 (0.38)
SCHEMBL8844136 0.80 SLC6A2 (0.37) HTR1ASLC6A2SLC6A4SLC6A3HTR3A
SCHEMBL30673624 0.77 HTR3A (0.38) HTR3A
SCHEMBL9901829 0.77 HTR3A (0.38) HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5622966-A BACTERICIDES TREATING INFECTIONS WARNER-LAMBERT COMPANY (US) 1997-04-22 US disclosed
US-5446044-A Bactericides WARNER-LAMBERT COMPANY (US) 1995-08-29 US disclosed
US-5384407-A Pyrrolidine compounds WARNER-LAMBERT COMPANY (US) 1995-01-24 US disclosed
US-5342844-A 7-substituted quinolones and naphthyridones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1994-08-30 US disclosed
WO-1993016077-A1 7-SUBSTITUTED QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1993-08-19 WO disclosed
US-5221676-A 7-substituted quinolones and naphthyridones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1993-06-22 US disclosed