SCHEMBL9518341

SCHEMBL9518341

CCCCC(=O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.38
TYRO3 Q06418 1/20 0.38
MERTK Q12866 1/20 0.38
GAS6 Q14393 1/20 0.38
SIRT2 Q8IXJ6 13/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL10457151 0.92 HPGD (0.39) FLT3TYRO3MERTKGAS6SIRT2
SCHEMBL1736018 0.88 SIRT2 (0.36) SIRT2
SCHEMBL1414901 0.86 SIRT2 (0.40) SIRT2
SCHEMBL1735234 0.85 CYP11B1 (0.37) SIRT2
SCHEMBL8865971 0.83 KCNH2 (0.42) SIRT2CES1
SCHEMBL9489847 0.81 SIRT2 (0.40) SIRT2
SCHEMBL4030251 0.80 SIRT2 (0.40) SIRT2
SCHEMBL1483017 0.80 SIRT2 (0.39) SIRT2CES2CES1
SCHEMBL7262693 0.79 SIRT2 (0.32) SIRT2
SCHEMBL1040045 0.79 CYP11B1 (0.41) SIRT2

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
EP-0239306-B1 TETRAHYDROCARBAZOLE ESTERS MERCK FROSST CANADA INC. (CA) 1993-06-02 EP claimed
CN-1198817-C N-cimidazolylalkyl) substituted cyclic amines as histamine-H3 agonists or antagonists SCHERING CORP (US) 2005-04-27 CN disclosed
CN-1323302-A N-cimidazolylalkyl) substituted cyclic amines as histamine-H3 agonists or antagonists SCHERING CORP (US) 2001-11-21 CN disclosed
EP-0269599-B1 Substituted 1H-imidazoles UCB SA (BE) 1993-12-15 EP disclosed
US-4814343-A ANTIISCHEMIC U C B, S.A. (BE) 1989-03-21 US disclosed
EP-0269599-A2 Substituted 1H-imidazoles U C B, S.A. (BE) 1988-06-01 EP disclosed