SCHEMBL31384473

SCHEMBL31384473

CCCCOc1ccc(C(=O)C(=O)N(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.57
▸ TP53 P04637 1/20 0.57
▸ PLA2G4B P0C869 2/20 0.55
▸ THRA P10827 1/20 0.55
▸ THRB P10828 1/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ RARB P10826 3/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ SMN1; SMN2 Q16637 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
SCHEMBL10932269 0.83 ALDH1A1 (0.61) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL12190754 0.82 TP53 (0.74) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL30475759 0.81 TP53 (0.77) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL30371836 0.81 TP53 (0.77) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL2369956 0.81 TP53 (0.77) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL15558380 0.81 TP53 (0.77) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL2847927 0.81 TP53 (0.77) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL30302445 0.81 TP53 (0.77) TSHRTP53PLA2G4BTHRATHRB
SCHEMBL16917421 0.81 TP53 (0.67) TSHRTP53PLA2G4BL3MBTL1RARB
SCHEMBL7637707 0.80 TP53 (0.66) TSHRTP53PLA2G4BTHRATHRB

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-119504474-A Preparation method of phenyl ketone amide compound 淮北师范大学 2025-02-25 — — CN disclosed
Send feedback