SCHEMBL20351805

SCHEMBL20351805

CN1CCCC(n2cc(I)c3c(Cl)ncnc32)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 7/20 0.47
▸ SLC29A1 Q99808 1/20 0.43
▸ ABL1 P00519 9/20 0.38
▸ MAP4K4 O95819 2/20 0.38
▸ PAK4 O96013 2/20 0.38
▸ LCK P06239 2/20 0.38
▸ FYN P06241 2/20 0.38
▸ CSF1R P07333 2/20 0.38
▸ RET P07949 2/20 0.38
▸ FGFR1 P11362 2/20 0.38
▸ FLT1 P17948 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ FLT3 P36888 2/20 0.38
▸ CSNK1A1 P48729 2/20 0.38
▸ LIMK1 P53667 2/20 0.38
▸ MAP4K2 Q12851 2/20 0.38
▸ ROCK1 Q13464 2/20 0.38
▸ NTRK3 Q16288 2/20 0.38
▸ NTRK2 Q16620 2/20 0.38
▸ AURKB Q96GD4 2/20 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
SCHEMBL18044685 0.95 ADK (0.51) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL6866845 0.90 ADK (0.47) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL16236759 0.90 ADK (0.47) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL16236581 0.88 ADK (0.49) ADKSLC29A1HTR6
SCHEMBL1939761 0.87 ADK (0.52) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL401328 0.87 ADK (0.52) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL20351806 0.86 ADK (0.46) ADKABL1MAP4K4PAK4LCK
SCHEMBL16236685 0.86 ADK (0.51) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL22086530 0.86 ADK (0.51) ADKSLC29A1ABL1MAP4K4PAK4
SCHEMBL30373169 0.86 ADK (0.51) ADKSLC29A1ABL1MAP4K4PAK4

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
CN-110036014-B Compound with AXL inhibitory activity and preparation and application thereof 中国科学院上海药物研究所 2021-09-07 — — CN disclosed
WO-2018121228-A1 COMPOUND HAVING AXL INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2018-07-05 — — WO disclosed
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