SCHEMBL29272276

SCHEMBL29272276

O=C(O)c1cc(C(=O)C(F)(F)F)ccn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 4/20 0.67
▸ KDM4E B2RXH2 3/20 0.67
▸ ALDH1A1 P00352 3/20 0.67
▸ ALKBH5 Q6P6C2 3/20 0.67
▸ ASPH Q12797 2/20 0.67
▸ KDM6B O15054 1/20 0.67
▸ TET3 O43151 1/20 0.67
▸ KDM4A O75164 1/20 0.67
▸ BBOX1 O75936 1/20 0.67
▸ MAPT P10636 1/20 0.67
▸ KDM5A P29375 1/20 0.67
▸ KDM5C P41229 1/20 0.67
▸ KDM4D Q6B0I6 1/20 0.67
▸ TET2 Q6N021 1/20 0.67
▸ KDM7A Q6ZMT4 1/20 0.67
▸ KDM8 Q8N371 1/20 0.67
▸ TET1 Q8NFU7 1/20 0.67
▸ EGLN2 Q96KS0 1/20 0.67
▸ EGLN1 Q9GZT9 1/20 0.67
▸ KDM4C Q9H3R0 1/20 0.67

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
SCHEMBL29272136 0.86 FTO (0.62) FTOKDM4EALDH1A1ALKBH5ASPH
SCHEMBL30237159 0.86 FTO (0.62) FTOKDM4EALDH1A1ALKBH5ASPH
SCHEMBL27599068 0.84 ACHE (0.46) FTOKDM4EALDH1A1ALKBH5ASPH
SCHEMBL29382783 0.81 KDM5C (1.00) FTOKDM4EALDH1A1ALKBH5ASPH
SCHEMBL72377 0.81 KDM5C (1.00) FTOKDM4EALDH1A1ALKBH5ASPH
Water SCHEMBL2650345 0.79 KDM5C (0.96) FTOKDM4EALDH1A1ALKBH5ASPH
SCHEMBL2276257 0.79 KDM5C (0.96) FTOKDM4EALDH1A1ALKBH5ASPH
Hydrochloric Acid SCHEMBL10778857 0.79 KDM5C (0.96) FTOKDM4EALDH1A1ALKBH5ASPH
SCHEMBL9585979 0.79 FTO (0.96) FTOKDM4EALDH1A1ALKBH5ASPH
Hydrochloric Acid SCHEMBL9361001 0.79 KDM5C (0.96) FTOKDM4EALDH1A1ALKBH5ASPH

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-118159537-A 6-Aza-quinoline derivatives and related uses 黑钻治疗公司 2024-06-07 — — CN disclosed
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