SCHEMBL28968032

SCHEMBL28968032

COc1cc(N2CCN(C)CC2)ccc1Nc1ccnc2cc(OC)c(C(N)=O)cc12

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 1/20 0.49
▸ CSF1R P07333 6/20 0.49
▸ CDK2 P24941 2/20 0.49
▸ CCNA2 P20248 1/20 0.49
▸ PLK1 P53350 1/20 0.49
▸ CCNA1 P78396 1/20 0.49
▸ PLK3 Q9H4B4 1/20 0.49
▸ PLK2 Q9NYY3 1/20 0.49
▸ ALK Q9UM73 3/20 0.48
▸ IGF1R P08069 2/20 0.48
▸ INSR P06213 1/20 0.48
▸ EGFR P00533 3/20 0.47
▸ PIM1 P11309 2/20 0.47
▸ TTK P33981 2/20 0.47
▸ PIM2 Q9P1W9 1/20 0.47
▸ DYRK1A Q13627 1/20 0.47
▸ DYRK1B Q9Y463 1/20 0.46
▸ RET P07949 1/20 0.45
▸ NEK2 P51955 1/20 0.45

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
SCHEMBL28885516 0.80 NCF1 (0.54) CSF1RRETNEK2
SCHEMBL30880547 0.78 PDGFRA (0.49) CSF1REGFRRET
SCHEMBL30880656 0.77 PDGFRA (0.48) CSF1REGFRRET
SCHEMBL4703621 0.76 NEK2 (0.61) NEK2
SCHEMBL30880630 0.76 MAPK10 (0.51) MAPK10EGFR
SCHEMBL11029725 0.75 CCNA2 (0.58) CDK2CCNA2PLK1CCNA1PLK3
SCHEMBL28431630 0.75 SRC (0.59) CSF1REGFRRET
SCHEMBL26086217 0.74 RAD52 (0.49) CDK2CCNA1IGF1REGFRTTK
SCHEMBL28968037 0.73 EGFR (0.50) CSF1REGFRRET
SCHEMBL30340614 0.72 ADRA2A (0.63) MAPK10CDK2IGF1REGFRDYRK1B

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-115466211-B N-phenylquinoline-4-amine compound and application thereof 中国人民解放军空军军医大学 2024-02-23 — — CN disclosed
CN-115466211-A N-phenylquinoline-4-amine compound and application thereof 中国人民解放军空军军医大学 2022-12-13 — — CN disclosed
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