Sugi Predict

Sugi Predict / Compounds / SCHEMBL9844183

SCHEMBL9844183

SCHEMBL9844183

CC(C)c1cccc(C(C)C)c1NC(=O)C(C)(C)C(=O)N(Cc1ccccc1)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ SOAT2 O75908 2/20 0.47
▸ SOAT1 P35610 2/20 0.47
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.43

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 0.79 KMT2A (0.65) KMT2AMEN1SOAT2SOAT1LMNA
SCHEMBL9843883 0.76 KMT2A (0.50) KMT2AMEN1SOAT2SOAT1LMNA
SCHEMBL9754297 0.76 KMT2A (0.57) KMT2AMEN1SOAT2SOAT1LMNA
Tebutam SCHEMBL11209192 0.74 MEN1 (0.65) KMT2AMEN1SMN1; SMN2
Tebutam SCHEMBL63650 0.74 MEN1 (0.65) KMT2AMEN1SMN1; SMN2
Tebutam SCHEMBL8539325 0.74 MEN1 (0.65) KMT2AMEN1SMN1; SMN2
SCHEMBL11143056 0.74 ALDH1A1 (0.58) KMT2ASOAT2SOAT1LMNASMN1; SMN2
SCHEMBL9680507 0.73 SOAT2 (0.55) KMT2AMEN1SOAT2SOAT1LMNA
SCHEMBL9678499 0.72 SMN1; SMN2 (0.53) KMT2AMEN1SOAT2SOAT1LMNA
SCHEMBL8962491 0.72 KMT2A (0.58) KMT2AMEN1SOAT2SOAT1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

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