SCHEMBL6899771

SCHEMBL6899771

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

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 3/20 0.62
SOAT2 O75908 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.55
KMT2A Q03164 5/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 4/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDM4E B2RXH2 1/20 0.46
UBE2M P61081 1/20 0.46
DCUN1D1 Q96GG9 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
SCHEMBL9844078 0.91 SOAT1 (0.56) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL13328398 0.90 SOAT2 (0.55) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL9844229 0.87 POLB (0.53) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL2147650 0.87 KMT2A (0.65) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL11143056 0.85 ALDH1A1 (0.58) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL9681145 0.84 SOAT2 (0.56) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL9680211 0.83 SOAT2 (0.52) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL9679656 0.82 SOAT2 (0.60) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL9679390 0.81 ALDH1A1 (0.58) SOAT1SOAT2SMN1; SMN2KMT2ALMNA
SCHEMBL9844236 0.81 SMN1; SMN2 (0.57) SOAT1SOAT2SMN1; SMN2KMT2ALMNA

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 12 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
US-20160271137-A1 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS UNIV PRINCETON (US) 2016-09-22 US disclosed
US-20160271137-A1 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS UNIV PRINCETON (US) 2016-09-22 US disclosed
US-9168269-B2 Inhibitors of long and very long chain fatty acid metabolism as broad spectrum anti-virals THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2015-10-27 US disclosed
US-9168269-B2 Inhibitors of long and very long chain fatty acid metabolism as broad spectrum anti-virals THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2015-10-27 US disclosed
US-20150139949-A1 ANTI-VIRAL COMBINATION THERAPY KOYUNCU EMRE (US) 2015-05-21 US disclosed
US-20150139949-A1 ANTI-VIRAL COMBINATION THERAPY KOYUNCU EMRE (US) 2015-05-21 US disclosed
US-20130190381-A1 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2013-07-25 US disclosed
US-20130190381-A1 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2013-07-25 US disclosed
WO-2012139028-A2 ANTI-VIRAL COMBINATION THERAPY THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2012-10-11 WO disclosed
WO-2011103516-A2 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2011-08-25 WO disclosed
EP-0433662-A2 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-26 EP 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 (3 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-20160271137-A1 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS FASN, PLIN1, PLIN3 SOAT1 117/4885SOAT2 105/4885SMN1; SMN2 4652/4885
US-20130190381-A1 INHIBITORS OF LONG AND VERY LONG CHAIN FATTY ACID METABOLISM AS BROAD SPECTRUM ANTI-VIRALS FASN, PLIN1, PLIN3 SOAT1 117/4885SOAT2 105/4885SMN1; SMN2 4652/4885
US-20150139949-A1 ANTI-VIRAL COMBINATION THERAPY HAVCR2, MAVS, ZC3HAV1 SOAT1 1223/4885SOAT2 1598/4885SMN1; SMN2 4448/4885

“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.