SCHEMBL24567215

SCHEMBL24567215

CC(C)(C)C(=O)Nc1cc(Cl)nn(C2=COCCC2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KLF5 Q13887 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ BRPF1 P55201 1/20 0.33
▸ GAA P10253 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TSHR P16473 1/20 0.31

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
SCHEMBL24567217 0.84 TMIGD3 (0.37) BRPF1GAA
SCHEMBL24007634 0.72 KDM4E (0.44) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL24007902 0.69 KDM4E (0.41) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL24567228 0.68 KDM4C (0.36) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL24567209 0.68 KDM4C (0.36) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL24815180 0.63 KDM4E (0.35) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL18383188 0.60 ALDH1A1 (0.43) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL18387539 0.60 L3MBTL1 (0.42) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL24007637 0.58 ADORA1 (0.46) KDM4EMITFALDH1A1HPGDKLF5
SCHEMBL18260522 0.57 KDM4E (0.39) KDM4EMITFALDH1A1HPGDKLF5

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-2022140527-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2022-06-30 — — WO disclosed
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