SCHEMBL28115226

SCHEMBL28115226

CC(=O)c1c(Cl)n(C)c2c(C)cccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALKBH5 Q6P6C2 1/20 0.46
▸ FTO Q9C0B1 1/20 0.46
▸ EGFR P00533 1/20 0.44
▸ SRC P12931 1/20 0.44
▸ RORC P51449 3/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ RECQL P46063 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HCRTR1 O43613 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ BRPF1 P55201 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ THRB P10828 1/20 0.37
▸ ABCB1 P08183 1/20 0.36
▸ CXCR3 P49682 1/20 0.36
▸ LMNA P02545 2/20 0.36

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
SCHEMBL28115225 0.83 EGFR (0.41) EGFRSRCNPC1SMN1; SMN2MAPT
SCHEMBL4106684 0.76 EGFR (0.68) EGFRSRCNPC1SMN1; SMN2MAPT
SCHEMBL26581400 0.75 ATM (0.55) ALKBH5FTOEGFRRORCNPC1
SCHEMBL28868912 0.73 ALKBH5 (0.46) ALKBH5FTOEGFRSRCRORC
SCHEMBL14931058 0.71 ALKBH5 (0.72) ALKBH5FTONPC1MAPTALDH1A1
SCHEMBL19276580 0.71 NQO2 (0.48) ALKBH5FTORORCNPC1MAPT
SCHEMBL22450932 0.69 MAPT (0.48) EGFRSRCNPC1SMN1; SMN2MAPT
SCHEMBL696352 0.69 THRB (0.56) NPC1SMN1; SMN2ALDH1A1RAB9ABRPF1
SCHEMBL13100052 0.69 ALDH1A1 (0.52) NPC1ALDH1A1KMT2AHCRTR1RAB9A
SCHEMBL12536109 0.68 BRD4 (0.56) ALKBH5FTORORCNPC1SMN1; SMN2

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
CN-105001220-B Preparation method of indoloquinoline alkaloid analogues 渤海大学 2017-01-11 — — CN disclosed
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