SCHEMBL38650636

SCHEMBL38650636

CC(C)c1c(Oc2c(Cl)cc(N)cc2Cl)cnn(C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 5/20 0.38
▸ MCHR1 Q99705 5/20 0.38
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ THRA P10827 6/20 0.36
▸ THRB P10828 6/20 0.36
▸ KAT2B Q92831 2/20 0.36
▸ BPTF Q12830 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ BRD9 Q9H8M2 1/20 0.33
▸ MAPT P10636 1/20 0.32

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
SCHEMBL38650532 0.84 SMN1; SMN2 (0.36) NPBWR1MCHR1ALDH1A1HPGDTHRA
SCHEMBL38650767 0.74 GAA (0.37) NPBWR1MCHR1KAT2BBPTFSMN1; SMN2
SCHEMBL22031949 0.73 KAT2B (0.39) ALDH1A1HPGDKAT2BATMSMN1; SMN2
SCHEMBL31735694 0.72 KAT2B (0.49) ALDH1A1HPGDKAT2BBPTFSMN1; SMN2
SCHEMBL2924750 0.70 THRB (0.67) THRATHRB
SCHEMBL29527903 0.68 THRB (0.40) NPBWR1MCHR1THRATHRB
SCHEMBL29526971 0.67 P2RX3 (0.37) THRBMAPT
SCHEMBL24449973 0.65 THRA (0.32) THRATHRB
SCHEMBL23259993 0.65 THRB (0.40) THRATHRB
SCHEMBL807533 0.64 CYP3A4 (0.52) ALDH1A1HPGDTHRBMAPT

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-112805005-B Thyroxine receptor beta agonist compounds 拓臻股份有限公司 2026-05-12 — — CN disclosed
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