SCHEMBL31406754

SCHEMBL31406754

CCN1CCN(Cc2ccc(Nc3nccc4c(N)c(C)ccc34)cc2C(F)(F)F)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.53
MAPK1 P28482 1/20 0.53
ATM Q13315 1/20 0.53
RAF1 P04049 2/20 0.52
RET P07949 2/20 0.48
MAPK14 Q16539 7/20 0.48
MAP3K7 O43318 5/20 0.48
MAP4K2 Q12851 5/20 0.48
MAP3K20 Q9NYL2 4/20 0.48
FES P07332 2/20 0.48
FER P16591 2/20 0.48
HCK P08631 2/20 0.48
NR2C2 P49116 2/20 0.48
MAP4K4 O95819 1/20 0.48
ABL1 P00519 1/20 0.48
LYN P07948 1/20 0.48
SRC P12931 1/20 0.48
EPHA2 P29317 1/20 0.48
EPHB2 P29323 1/20 0.48
FLT3 P36888 1/20 0.48

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
SCHEMBL24399682 0.84 BRAF (0.43) HTTMAPK1ATMRAF1KDR
SCHEMBL30559436 0.84 BRAF (0.43) HTTMAPK1ATMRAF1KDR
SCHEMBL15066469 0.78 RAF1 (0.66) HTTMAPK1ATMRAF1MAPK14
SCHEMBL24268077 0.77 RAPGEF4 (0.49) RAF1MAPK14KDRBRAF
SCHEMBL15067380 0.75 RAF1 (0.55) HTTMAPK1ATMRAF1RET
SCHEMBL21387832 0.74 RAF1 (0.63) HTTMAPK1ATMRAF1MAPK14
SCHEMBL15066398 0.73 RAF1 (0.53) HTTMAPK1ATMRAF1MAPK14
SCHEMBL15066728 0.73 NR1H2 (0.46) HTTMAPK1ATMRAF1RET
SCHEMBL24399710 0.72 FAAH (0.43) KDRBRAF
SCHEMBL29638708 0.72 FAAH (0.43) KDRBRAF

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
EP-3617213-B1 THIENO[3,2-D]PYRIMIDINE DERIVATIVES HAVING INHIBITORY ACTIVITY FOR PROTEIN KINASES HANMI PHARMACEUTICAL CO LTD (KR) 2025-02-19 EP disclosed