SCHEMBL23966368

SCHEMBL23966368

COc1cc(N)cc(N(CCNC(C)C)c2ccc3ncc(-c4cnn(C)c4)nc3n2)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 20/20 0.68
FGFR2 P21802 20/20 0.68
FGFR3 P22607 20/20 0.68
FGFR4 P22455 18/20 0.68
KDR P35968 17/20 0.68
ADORA3 P0DMS8 1/20 0.68
CHRM1 P11229 1/20 0.68
ADRA2C P18825 1/20 0.68
SLC6A2 P23975 1/20 0.68
SLC6A4 P31645 1/20 0.68
DRD3 P35462 1/20 0.68
OPRD1 P41143 1/20 0.68
ETV6 P41212 1/20 0.68
HTR2B P41595 1/20 0.68
SLC6A3 Q01959 1/20 0.68
PDE4D Q08499 1/20 0.68
FLT3 P36888 11/20 0.64

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
SCHEMBL14901133 0.94 FGFR1 (0.76) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL14901164 0.83 FGFR3 (0.74) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL14901182 0.83 FGFR3 (0.78) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL18021081 0.82 FGFR3 (0.73) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL16125208 0.82 FGFR3 (0.75) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL14901309 0.82 FGFR1 (0.77) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL23667656 0.81 FGFR1 (0.71) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL14905516 0.81 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
Erdafitinib SCHEMBL2583760 0.81 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
Erdafitinib SCHEMBL29359988 0.81 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR

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-3353164-B1 BI-HETEROARYL SUBSTITUTED 1,4-BENZODIAZEPINES AND USES THEREOF FOR THE TREATMENT OF CANCER JANSSEN PHARMACEUTICA NV (BE) 2021-11-03 EP disclosed