SCHEMBL12469508

SCHEMBL12469508

CCNC(=O)c1ccc(-c2ccc(N)cc2F)c2c1C(=O)NC2.Nc1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.40
KDR P35968 1/20 0.37
FLT3 P36888 1/20 0.36
TYK2 P29597 7/20 0.36
JAK2 O60674 3/20 0.36
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35

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
SCHEMBL12469573 0.89 ALPL (0.40) BTKKDRFLT3
SCHEMBL12469562 0.89 BTK (0.42) BTKKDRFLT3
SCHEMBL12469038 0.88 PARP1 (0.40) BTKKDR
SCHEMBL12469505 0.87 BTK (0.41) BTKKDRFLT3
SCHEMBL12469540 0.86 L3MBTL1 (0.40) BTK
SCHEMBL12469481 0.86 ALOX5 (0.40) BTKKDRFLT3
SCHEMBL12469581 0.85 CACNA1G (0.43) KDR
SCHEMBL12469765 0.84 AURKA (0.40) BTKKDRFLT3
SCHEMBL12469512 0.84 CRBN (0.41) BTK
SCHEMBL12469605 0.84 BTK (0.44) BTKKDRFLT3TYK2JAK2

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
WO-2012047017-A2 2,3-DIHYDRO-ISOINDOL-1-ONE DERIVATIVE AND A COMPOSITION COMPRISING THE SAME 크리스탈지노믹스(주) (KR) 2012-04-12 WO disclosed