SCHEMBL21317668

SCHEMBL21317668

CNc1cccc(-c2nc(Nc3ccc(CN4CCN(C)CC4)cc3)ncc2C)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 10/20 0.81
▸ FGFR1 P11362 1/20 0.50
▸ CDK2 P24941 3/20 0.49
▸ AURKA O14965 1/20 0.49
▸ PDPK1 O15530 1/20 0.49
▸ CCNA2 P20248 2/20 0.48
▸ CCNA1 P78396 1/20 0.48
▸ CDK1 P06493 1/20 0.48
▸ KDR P35968 1/20 0.48
▸ ABL1 P00519 1/20 0.47
▸ PDGFRB P09619 1/20 0.47
▸ BCR P11274 1/20 0.47
▸ SRC P12931 1/20 0.47
▸ PDGFRA P16234 1/20 0.47
▸ SYK P43405 1/20 0.47
▸ JAK2 O60674 1/20 0.47
▸ JAK3 P52333 1/20 0.47
▸ PTK2 Q05397 1/20 0.47
▸ CCNT1 O60563 1/20 0.47
▸ CDK9 P50750 1/20 0.47

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
SCHEMBL12964729 0.89 AXL (1.00) AXLFGFR1PDPK1
SCHEMBL12964793 0.88 AXL (0.74) AXLCDK2AURKACCNA2CCNA1
SCHEMBL12964797 0.87 AXL (0.78) AXLFGFR1KDR
SCHEMBL12964795 0.85 AXL (0.75) AXLFGFR1ABL1BCRPDGFRA
SCHEMBL12964796 0.84 AXL (0.73) AXL
SCHEMBL25549973 0.83 AXL (0.72) AXLFGFR1
SCHEMBL25549942 0.82 AXL (0.71) AXLFGFR1CDK2AURKACCNA2
SCHEMBL12813489 0.82 AXL (0.77) AXLCDK1KDRJAK2
SCHEMBL12813376 0.82 AXL (1.00) AXLCDK1KDR
SCHEMBL12964726 0.81 AXL (0.70) AXLCDK1KDRJAK2JAK3

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-2693881-B1 SUBSTITUTED N-PHENYLPYRIMIDIN-2-AMINE ANALOGS AS INHIBITORS OF THE AXL KINASE UNIV UTAH RES FOUND (US) 2019-09-04 — — EP disclosed
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