SCHEMBL27255482

SCHEMBL27255482

CNSc1cnc2c(ccn2-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 4/20 0.45
LCK P06239 1/20 0.36
KIT P10721 1/20 0.36
SRC P12931 1/20 0.36
KDR P35968 1/20 0.36
MCHR1 Q99705 1/20 0.34
KCNH2 Q12809 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
GRM2 Q14416 2/20 0.33
CDC7 O00311 1/20 0.33
CDK2 P24941 1/20 0.33
CHRNA7 P36544 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
DGAT1 O75907 1/20 0.32
NR3C1 P04150 1/20 0.32
XDH P47989 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
DHFR P00374 1/20 0.32
PTPN11 Q06124 1/20 0.31

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
SCHEMBL27255478 0.83 PTK2 (0.42) PTK2LCKKITSRCKDR
SCHEMBL27255493 0.78 PTPN11 (0.37) PTK2TDP1NR3C1XDHPTPN11
SCHEMBL27255164 0.77 KCNH2 (0.51) PTK2LCKKITSRCKDR
SCHEMBL31591370 0.77 PTK2 (0.44) PTK2LCKKITSRCKDR
SCHEMBL14136858 0.77 PTK2 (0.44) PTK2LCKKITSRCKDR
SCHEMBL27255485 0.77 MAPT (0.43) PTK2LCKKITSRCKDR
SCHEMBL31591387 0.76 ALOX15B (0.51) PTK2CYP1A2CYP2C19
SCHEMBL27255475 0.76 ALOX15B (0.51) PTK2CYP1A2CYP2C19
SCHEMBL16167709 0.75 PTK2 (0.46) PTK2LCKKITSRCKDR
SCHEMBL27255480 0.72 PTK2 (0.40) PTK2LCKKITSRCKDR

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-2024080792-A1 NOVEL HETEROBICYCLIC COMPOUND FOR INHIBITING YAP-TEAD INTERACTION AND PHARMACEUTICAL COMPOSITION COMPRISING SAME HANMI PHARM. CO., LTD. (KR) 2024-04-18 WO disclosed