SCHEMBL9681037

SCHEMBL9681037

COC(=O)c1ccc(C(=O)N(CC(=O)Nc2c(C(C)C)cccc2C(C)C)C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SOAT2 O75908 1/20 0.43
SOAT1 P35610 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
SCHEMBL9679675 0.85 KMT2A (0.43) KMT2AMEN1LMNASMN1; SMN2SOAT2
SCHEMBL9678803 0.84 KMT2A (0.50) KMT2AMEN1LMNASMN1; SMN2SOAT2
SCHEMBL9680708 0.83 LPAR1 (0.49) KMT2AMEN1SMN1; SMN2SOAT2SOAT1
SCHEMBL9851048 0.82 KMT2A (0.54) KMT2AMEN1LMNASMN1; SMN2SOAT2
SCHEMBL9678925 0.79 LPAR1 (0.49) KMT2AMEN1LMNASMN1; SMN2
SCHEMBL9680221 0.79 KMT2A (0.49) KMT2AMEN1LMNASMN1; SMN2SOAT2
SCHEMBL9679644 0.78 KMT2A (0.44) KMT2AMEN1LMNASMN1; SMN2SOAT2
SCHEMBL9680252 0.77 LPAR1 (0.58) KMT2AMEN1LMNASMN1; SMN2
SCHEMBL9680261 0.76 CYP2C19 (0.54) KMT2AMEN1LMNASMN1; SMN2
SCHEMBL9680196 0.74 KMT2A (0.45) KMT2AMEN1LMNASMN1; SMN2SOAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP claimed
US-5153226-A Administering as anticholesterol agents, for atherosclerosis WARNER-LAMBERT COMPANY (US) 1992-10-06 US disclosed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP disclosed