SCHEMBL10191990

SCHEMBL10191990

Cc1cccc(NC(=O)OCC(C)C)c1

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.79
HTT P42858 3/20 0.79
TSHR P16473 2/20 0.79
ALOX15 P16050 1/20 0.79
L3MBTL1 Q9Y468 1/20 0.79
MAPK1 P28482 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
ALDH1A1 P00352 5/20 0.56
GAA P10253 1/20 0.56
HSD17B10 Q99714 2/20 0.54
FAAH O00519 1/20 0.54
CYP3A4 P08684 1/20 0.54
MAPT P10636 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HPGD P15428 2/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MAOB P27338 1/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL14595032 0.86 LMNA (0.62) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL14622137 0.85 LMNA (0.60) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL10937909 0.85 LMNA (0.60) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL3424143 0.84 MAPK1 (0.69) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL4962812 0.84 HPGD (0.68) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL7091790 0.84 LMNA (0.58) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL5209200 0.84 LMNA (0.58) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL8602983 0.82 LMNA (0.74) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL10192053 0.81 HSD17B10 (0.57) LMNAHTTTSHRALOX15L3MBTL1
SCHEMBL10192028 0.81 SMN1; SMN2 (0.61) LMNAHTTTSHRALOX15L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2011-11-03 US disclosed
US-8013006-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-09-06 US disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO disclosed
US-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 US disclosed
US-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus PTC THERAPEUTICS, INC. 2008-04-24 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 (5 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-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus EIF2AK2, INMT, IDO1 LMNA 4373/4885HTT 1585/4885TSHR 4191/4885
US-20110268698-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, LIPC, HCCS LMNA 1241/4885HTT 4087/4885TSHR 4465/4885
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS LMNA 3101/4885HTT 3355/4885TSHR 4324/4885
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS LMNA 1012/4885HTT 3147/4885TSHR 4161/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS LMNA 1012/4885HTT 3147/4885TSHR 4161/4885

“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.