SCHEMBL27452503

SCHEMBL27452503

CC(=O)NC1CC(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)C1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.58
▸ MMP2 P08253 1/20 0.57
▸ MMP9 P14780 1/20 0.57
▸ MMP8 P22894 1/20 0.57
▸ MMP13 P45452 1/20 0.57
▸ FAAH O00519 1/20 0.56
▸ EPHX2 P34913 1/20 0.56
▸ MGLL Q99685 8/20 0.55
▸ KCNK2 O95069 1/20 0.54
▸ KCNK4 Q9NYG8 1/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ MAPT P10636 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ GAA P10253 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ APP P05067 1/20 0.52
▸ GLA P06280 1/20 0.52

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
SCHEMBL27452500 0.93 KCNK2 (0.59) TP53MMP2MMP9MMP8MMP13
SCHEMBL27452652 0.86 TP53 (0.57) TP53MMP2MMP9MMP8MMP13
SCHEMBL2243918 0.85 FAAH (0.69) TP53MMP2MMP9MMP8MMP13
SCHEMBL7107437 0.83 FAAH (0.67) TP53MMP2MMP9MMP8MMP13
SCHEMBL29636830 0.82 RAB9A (0.74) TP53MMP2MMP9MMP8MMP13
SCHEMBL7105704 0.82 RAB9A (0.74) TP53MMP2MMP9MMP8MMP13
SCHEMBL27452647 0.80 FAAH (0.58) TP53MMP2MMP9MMP8MMP13
SCHEMBL20379246 0.76 MMP2 (0.78) TP53MMP2MMP9MMP8MMP13
SCHEMBL27452587 0.76 FAAH (0.58) TP53MMP2MMP9MMP8MMP13
SCHEMBL10709034 0.76 MGLL (0.70) TP53MMP2MMP9MMP8MMP13

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-2024145662-A1 2-SUBSTITUTED THIAZOLE AND BENZOTHIAZOLE COMPOSITIONS AND METHODS AS DUX4 INHIBITORS ALTAY THERAPEUTICS, INC. (US) 2024-07-04 — — WO disclosed
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