SCHEMBL9843954

SCHEMBL9843954

CC(C)c1cccc(C(C)C)c1NC(=O)CC(=O)N(Cc1cccnc1)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 3/20 0.47
▸ SOAT2 O75908 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ FNTA P49354 1/20 0.47
▸ FNTB P49356 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ PSMB5 P28074 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ LMNA P02545 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL2147650 0.86 KMT2A (0.65) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL9844053 0.81 KMT2A (0.50) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL9843942 0.80 MEN1 (0.49) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL3308654 0.79 MEN1 (0.48) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL27368695 0.78 KMT2A (0.56) MEN1KMT2AFNTAFNTBGAA
SCHEMBL9844301 0.77 MEN1 (0.46) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL6899771 0.73 SOAT1 (0.62) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL9843936 0.72 SMN1; SMN2 (0.77) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL9844078 0.69 SOAT1 (0.56) SOAT1SOAT2MEN1KMT2ASMN1; SMN2
SCHEMBL9265862 0.69 UBE2M (0.56) FNTAFNTBALDH1A1LMNA

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-0433662-A2 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-26 — — EP claimed
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