SCHEMBL9250598

SCHEMBL9250598

CCCCNC1CC(C)(C)N(c2ncnc(N3C(C)(C)CC(NCCCC)CC3(C)C)n2)C(C)(C)C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.33
TYRO3 Q06418 1/20 0.33
MERTK Q12866 1/20 0.33
GAS6 Q14393 1/20 0.33
CYP2C9 P11712 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
DRD2 P14416 1/20 0.30
DRD3 P35462 1/20 0.30
HRH4 Q9H3N8 1/20 0.30

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
SCHEMBL4581818 0.89 FLT3 (0.31) FLT3TYRO3MERTKGAS6CYP2C9
SCHEMBL10589719 0.89 ALDH1A1 (0.42) FLT3TYRO3MERTKGAS6
SCHEMBL39151 0.83
SCHEMBL6934625 0.81
SCHEMBL9371300 0.78 ALDH1A1 (0.46) CYP2C9
SCHEMBL6932262 0.77 MEN1 (0.35) FLT3TYRO3MERTKGAS6HRH4
SCHEMBL6050522 0.76 VCP (0.32) FLT3TYRO3MERTKGAS6
SCHEMBL10589189 0.76 MERTK (0.43) FLT3TYRO3MERTKGAS6HRH4
SCHEMBL28499411 0.74 BCHE (0.40) DRD2DRD3
SCHEMBL870335 0.74 S1PR4 (0.37) FLT3TYRO3MERTKGAS6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105056291-B The coated adhesive composition of soft tissue adhesive composition, wound or wound coating composition 三井化学株式会社 2017-10-10 CN disclosed
WO-1995025767-A1 PROCESS FOR THE STABILIZATION OF HDPE CIBA-GEIGY AG (CH) 1995-09-28 WO disclosed