SCHEMBL9518110

SCHEMBL9518110

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

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.39
TYRO3 Q06418 1/20 0.39
MERTK Q12866 1/20 0.39
GAS6 Q14393 1/20 0.39
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SIRT2 Q8IXJ6 14/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
ENPP2 Q13822 1/20 0.33
RIPK1 Q13546 1/20 0.33

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
SCHEMBL10457235 0.93 SIRT2 (0.37) FLT3TYRO3MERTKGAS6SIRT2
SCHEMBL5060964 0.87 LMNA (0.40) FLT3TYRO3MERTKGAS6SIRT2
SCHEMBL1736246 0.86 CYP11B1 (0.37) FLT3TYRO3MERTKGAS6SIRT2
SCHEMBL8865638 0.85 FAAH (0.38) SIRT2CYP11B1CYP11B2
SCHEMBL8865969 0.83 SIRT2 (0.34) SIRT2CYP11B1CYP11B2
SCHEMBL31646315 0.82 CYP11B1 (0.38) SIRT2CYP11B1CYP11B2ENPP2
SCHEMBL6363934 0.81 SIRT2 (0.38) SIRT2CYP11B1CYP11B2ENPP2
SCHEMBL8865051 0.80 ADRB2 (0.37) SIRT2
SCHEMBL8865286 0.80 SIRT2 (0.39) KDM4EALDH1A1SIRT2CYP11B1CYP11B2
SCHEMBL1039275 0.80 CYP11B1 (0.41) FLT3TYRO3MERTKGAS6SIRT2

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
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