SCHEMBL9470522

SCHEMBL9470522

CC(C)c1cccc(C(C)C)c1NC(=O)C(Cl)(Cl)Cl

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
KMT2A Q03164 2/20 0.56
LMNA P02545 1/20 0.56
MEN1 O00255 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
NLRP3 Q96P20 2/20 0.47
LPAR1 Q92633 2/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
ATM Q13315 1/20 0.46
SOAT2 O75908 1/20 0.46
SOAT1 P35610 1/20 0.46

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
SCHEMBL901604 0.84 KMT2A (0.57) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL28634783 0.79 SMN1; SMN2 (0.66) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL9754297 0.79 KMT2A (0.57) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL462304 0.79 LPAR1 (0.66) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL6429941 0.79 KMT2A (0.65) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL19422608 0.78 SMN1; SMN2 (0.55) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL1726368 0.77 KMT2A (0.62) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL8845511 0.77 KMT2A (0.68) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL15243085 0.77 KMT2A (0.50) SMN1; SMN2KMT2ALMNAMEN1TDP1
SCHEMBL31155743 0.77 KMT2A (0.58) SMN1; SMN2KMT2ALMNAMEN1LPAR1

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-5219859-A Chloesterol acyltransferase inhibitors; antilipemic agents; antidiabetic agents; atherosclerosis LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1993-06-15 US disclosed