SCHEMBL28038176

SCHEMBL28038176

CC(=O)Oc1c(-c2nc(C(F)(F)F)cs2)cnn1C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PLAT P00750 1/20 0.36
▸ PIM1 P11309 2/20 0.33
▸ FLT3 P36888 1/20 0.32
▸ TYRO3 Q06418 1/20 0.32
▸ MERTK Q12866 1/20 0.32
▸ GAS6 Q14393 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ PDE10A Q9Y233 2/20 0.32
▸ FABP4 P15090 1/20 0.30
▸ FABP5 Q01469 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
SCHEMBL16003298 0.78 PDE10A (0.41) PLATPIM1FLT3TYRO3MERTK
SCHEMBL16003582 0.78 PDE10A (0.39) PLATPIM1FLT3TYRO3MERTK
SCHEMBL28338621 0.77 PDE10A (0.40) PLATPIM1FLT3TYRO3MERTK
SCHEMBL16321389 0.77 PDE10A (0.38) PLATPIM1FLT3TYRO3MERTK
SCHEMBL16340969 0.76 PLAT (0.39) PLATPIM1FLT3TYRO3MERTK
SCHEMBL28038250 0.75 ALDH1A1 (0.37) HPGDPDE10A
SCHEMBL28135268 0.74 PLAT (0.38) PLATPIM1FLT3TYRO3MERTK
SCHEMBL28038156 0.69 PDE10A (0.37) PDE10A
SCHEMBL27996600 0.68 LPAR1 (0.42) MAPTHPGD
SCHEMBL18062305 0.68 PDE10A (0.40) PIM1MAPTNPSR1POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105189493-A Novel Pyrazole Derivatives MOCHIDA PHARM CO LTD 2015-12-23 — — CN disclosed
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