SCHEMBL20911841

SCHEMBL20911841

CCOc1ccc(-c2cn(-c3ccccc3)c3ncnc(Cl)c23)cc1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.73
▸ MAPT P10636 6/20 0.62
▸ LMNA P02545 4/20 0.62
▸ POLB P06746 1/20 0.61
▸ KDM4E B2RXH2 2/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ EGFR P00533 4/20 0.58
▸ KDR P35968 3/20 0.58
▸ ABL1 P00519 2/20 0.58
▸ ABL2 P42684 2/20 0.58
▸ HTT P42858 1/20 0.55
▸ TP53 P04637 2/20 0.53
▸ CDK1 P06493 1/20 0.52
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51

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
SCHEMBL20912242 0.88 SRC (0.76) SRCMAPTLMNAKDM4EALDH1A1
SCHEMBL20912366 0.86 SRC (0.70) SRCMAPTLMNAPOLBKDM4E
SCHEMBL30628875 0.86 SRC (0.65) SRCMAPTLMNAPOLBKDM4E
SCHEMBL20912251 0.86 SRC (0.65) SRCMAPTLMNAPOLBKDM4E
SCHEMBL20911996 0.86 SRC (0.65) SRCMAPTLMNAPOLBKDM4E
SCHEMBL20911998 0.86 SRC (0.65) SRCMAPTLMNAPOLBKDM4E
SCHEMBL20911877 0.86 SRC (0.65) SRCMAPTLMNAPOLBKDM4E
SCHEMBL20911833 0.85 SRC (0.64) SRCMAPTLMNAPOLBKDM4E
SCHEMBL22604442 0.85 SRC (1.00) SRCLMNASMN1; SMN2EGFRKDR
SCHEMBL20911997 0.84 SRC (0.63) SRCMAPTLMNAPOLBKDM4E

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
WO-2019073253-A1 MAP4K4 INHIBITORS IMPERIAL INNOVATIONS LIMITED (GB) 2019-04-18 — — WO disclosed
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