SCHEMBL8689406

SCHEMBL8689406

O=C1SC(=Cc2c[nH]c3ccccc23)C(=O)N1Cc1ccccc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL8687249 0.89 ESRRA (0.45) PIM1
SCHEMBL8687825 0.84 PIM1 (0.49) PIM1MEN1KMT2A
SCHEMBL6235055 0.78 MEN1 (0.56) ALDH1A1MEN1KMT2A
SCHEMBL6235054 0.78 MEN1 (0.56) ALDH1A1MEN1KMT2A
SCHEMBL8688100 0.77 ESRRA (0.44) PIM1
SCHEMBL1613781 0.77 PIM1 (0.53) PIM1ALDH1A1MEN1KMT2A
SCHEMBL5470542 0.76 PTPN1 (0.48) MEN1KMT2A
SCHEMBL5470545 0.76 PTPN1 (0.48) MEN1KMT2A
SCHEMBL1614943 0.74 PIM1 (0.53) PIM1ALDH1A1MEN1KMT2A
SCHEMBL13780771 0.73 MMP1 (0.54) ALDH1A1

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
US-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 — — US disclosed
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