SCHEMBL24715171

SCHEMBL24715171

CCC(CC)Oc1cc2c(Nc3cc(-c4ccccc4)ccc3OC)ncnc2cc1OC

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.61
RET P07949 5/20 0.56
KDR P35968 4/20 0.56
LCK P06239 1/20 0.55
FLT1 P17948 2/20 0.54
ATM Q13315 1/20 0.53
FGFR1 P11362 1/20 0.51
ABCG2 Q9UNQ0 2/20 0.50
KIF5B P33176 1/20 0.50
CLK1 P49759 1/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
RIPK2 O43353 1/20 0.50
EPHB2 P29323 1/20 0.50

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
SCHEMBL24713989 0.93 EGFR (0.55) EGFRRETKDRLCKFLT1
SCHEMBL24714946 0.86 EGFR (0.49) EGFRRETKDRFLT1FGFR1
SCHEMBL24713892 0.86 KDR (0.54) EGFRRETKDRFLT1FGFR1
SCHEMBL24714641 0.86 EGFR (0.56) EGFRRETKDRLCKFLT1
SCHEMBL24714041 0.86 EGFR (0.47) EGFRRETKDRFLT1FGFR1
SCHEMBL24714943 0.84 EGFR (0.56) EGFRRETKDRLCKFLT1
SCHEMBL24714932 0.82 KDR (0.52) EGFRRETKDRLCKFLT1
SCHEMBL24714561 0.82 EGFR (0.54) EGFRRETKDRFLT1FGFR1
SCHEMBL24714929 0.82 EGFR (0.54) EGFRRETKDRLCKFLT1
SCHEMBL24713875 0.79 EGFR (0.55) EGFRRETKDRLCKFLT1

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-2022225238-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 보로노이 주식회사 2022-10-27 WO disclosed