SCHEMBL3964040

SCHEMBL3964040

CC(C)N1CCN(CCCNc2ncc(Cl)c(-c3cc4c(C(=O)NC5CC5)cccc4s3)n2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 11/20 0.44
EGFR P00533 3/20 0.44
FGFR2 P21802 3/20 0.44
FGFR4 P22455 3/20 0.44
FGFR3 P22607 3/20 0.44
FLT3 P36888 6/20 0.43
TYRO3 Q06418 6/20 0.43
MERTK Q12866 6/20 0.43
AXL P30530 4/20 0.43
GAS6 Q14393 4/20 0.43
SRC P12931 2/20 0.39
PRKD3 O94806 1/20 0.38
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCI P41743 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCZ Q05513 1/20 0.38

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
SCHEMBL4073584 0.93 FGFR1 (0.49) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3961798 0.93 FGFR1 (0.49) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL4084184 0.93 FGFR1 (0.49) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3966471 0.92 FGFR1 (0.43) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3961618 0.91 FGFR1 (0.45) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3965688 0.91 FLT3 (0.43) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3961599 0.91 FGFR1 (0.44) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3961560 0.91 FGFR1 (0.47) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3967150 0.90 FGFR1 (0.48) FGFR1EGFRFGFR2FGFR4FGFR3
Hydrochloric Acid SCHEMBL3970123 0.90 FGFR1 (0.46) FGFR1EGFRFGFR2FGFR4FGFR3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009040659-A2 BENZENESULFONAMIDE COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. (DE) 2009-04-02 WO claimed
EP-1989200-B1 [4-(BENZO[B]THIOPHEN-2-YL)-PYRIMIDIN-2-YL]-AMINE DERIVATIVES AS IKK-BETA INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASES LILLY CO ELI (US) 2009-07-29 EP disclosed