SCHEMBL3955253

SCHEMBL3955253

CC(C)c1cccc(C(C)C)c1NC(=O)Oc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.59
LMNA P02545 2/20 0.59
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 2/20 0.54
GAA P10253 2/20 0.54
TP53 P04637 1/20 0.54
NLRP3 Q96P20 2/20 0.54
MAPT P10636 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
CCNE1 P24864 1/20 0.51
CDK2 P24941 1/20 0.51
CDK5 Q00535 1/20 0.51
LPAR1 Q92633 1/20 0.50
CYP1A2 P05177 1/20 0.50
SOAT2 O75908 1/20 0.49
SOAT1 P35610 1/20 0.49
MAPK1 P28482 1/20 0.49
KDM4E B2RXH2 1/20 0.48
THRB P10828 1/20 0.48
GFER P55789 1/20 0.48

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
SCHEMBL6280538 0.86 ALDH1A1 (0.50) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL13437400 0.84 NLRP3 (0.56) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL24979092 0.82 CCNE1 (0.50) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL30162804 0.82 CCNE1 (0.50) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL10489762 0.81 ALDH1A1 (0.49) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL10526068 0.78 ALDH1A1 (0.56) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL8845511 0.77 KMT2A (0.68) KMT2ALMNAMEN1NLRP3SMN1; SMN2
SCHEMBL15105404 0.76 KMT2A (0.60) KMT2ALMNAALDH1A1MEN1GAA
SCHEMBL26181211 0.76 NLRP3 (0.72) KMT2ALMNAALDH1A1MEN1NLRP3
SCHEMBL9723542 0.75 NLRP3 (0.55) KMT2ALMNAMEN1NLRP3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531576-B2 Biphenyl derivatives POLA CHEMICAL INDUSTRIES, INC. (JP) 2009-05-12 US disclosed
EP-1354871-B1 BIPHENYL DERIVATIVES POLA PHARMA INC (JP) 2008-02-20 EP disclosed
US-20040048909-A1 N-alkyl-N-(p-substituted-phenyl)benzylamine that is N-substituted with carbocyclic aminocarbonylalkylene, aminocarbonyl, or aminocarbonylaminosulfonyl; ACAT inhibitors; treating e.g.,hypercholesterolemia and atherosclerosis POLA CHEMICAL INDUSTRIES, INC. (JP) 2004-03-11 US disclosed
EP-1354871-A1 BIPHENYL DERIVATIVES POLA CHEMICAL INDUSTRIES, INC. (JP) 2003-10-22 EP disclosed
US-5925762-A REACTING PRIMARY PHENYL CARBAMATE OR THIOCARBAMATE WITH AMMONIA, A PRIMARY OR SECONDARY AMINE IN DIMETHYLSULFOXIDE BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1999-07-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040048909-A1 N-alkyl-N-(p-substituted-phenyl)benzylamine that is N-substituted with carbocyclic aminocarbonylalkylene, aminocarbonyl, or aminocarbonylaminosulfonyl; ACAT inhibitors; treating e.g.,hypercholesterolemia and atherosclerosis ACAT2, LCAT, NAT1 KMT2A 423/4885LMNA 857/4885ALDH1A1 1988/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.