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SCHEMBL27005709

SCHEMBL27005709

CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2cc(-c3ccc(C#N)c(F)c3)c(-c3ccc(O)c(F)c3)s2)C1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4D Q6B0I6 2/20 0.46
▸ RET P07949 1/20 0.42
▸ KDM1A O60341 14/20 0.41
▸ ALOX5AP P20292 1/20 0.41
▸ FEN1 P39748 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.40
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39

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
SCHEMBL27005479 0.91 KDM1A (0.46) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27006082 0.90 RET (0.43) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27005777 0.90 KDM4D (0.51) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27006084 0.90 RET (0.43) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27005837 0.89 ALOX5AP (0.42) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27005518 0.89 KDM1A (0.47) KDM4DRETKDM1A
SCHEMBL27005737 0.89 ALOX5AP (0.46) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27005845 0.89 ALOX5AP (0.46) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27005729 0.89 RET (0.42) KDM4DRETKDM1AALOX5APFEN1
SCHEMBL27005708 0.88 KDM4D (0.44) KDM4DRETKDM1AALOX5APFEN1

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
EP-4306520-A1 THIOPHENE COMPOUND AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2024-01-17 — — EP disclosed