SCHEMBL8908134

SCHEMBL8908134

COC(=O)N[C@H](CCc1ccccc1)CC(=O)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSG P08311 3/20 0.50
CTRB1 P17538 3/20 0.50
PRSS1 P07477 2/20 0.44
CMA1 P23946 2/20 0.44
CTSS P25774 1/20 0.44
CTSK P43235 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
HPGD P15428 1/20 0.43
ALDH1A1 P00352 2/20 0.42
ATM Q13315 1/20 0.41
CNR2 P34972 1/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL8908191 0.86 ATM (0.52) CTRB1CTSSATM
SCHEMBL10120447 0.86 ATM (0.52) CTRB1CTSSATM
SCHEMBL18526778 0.86 CTSG (0.55) CTSGCTRB1SMN1; SMN2KMT2AMEN1
SCHEMBL755367 0.86 CTSG (0.55) CTSGCTRB1SMN1; SMN2KMT2AMEN1
SCHEMBL14886206 0.85 CTSG (0.53) CTSGCTRB1SMN1; SMN2KMT2AMEN1
SCHEMBL890119 0.85 CTSG (0.53) CTSGCTRB1SMN1; SMN2KMT2AMEN1
SCHEMBL888749 0.82 CTSG (0.51) CTSGCTRB1SMN1; SMN2KMT2AMEN1
SCHEMBL22361440 0.82 CTSG (0.51) CTSGCTRB1SMN1; SMN2KMT2AMEN1
SCHEMBL8917994 0.82 CTSG (0.54) CTSGCTRB1PRSS1CMA1CTSK
SCHEMBL18782977 0.80 CTSG (0.49) CTSGCTRB1SMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752611-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2020-08-25 US disclosed
US-9127021-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2015-09-08 US disclosed
US-8637561-B2 Linked diimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2014-01-28 US disclosed
US-20130295049-A1 LINKED DIBENZIMIDAZOLE ANTIVIRALS ENANTA PHARMACEUTICALS, INC (US) 2013-11-07 US disclosed
US-8188132-B2 Linked dibenzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
US-8188132-B2 Linked dibenzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
US-20110300104-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-12-08 US disclosed
US-20110250172-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-10-13 US disclosed
US-20110250172-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-10-13 US disclosed
US-20110142798-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-06-16 US disclosed
US-20100226883-A1 LINKED DIIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2010-09-09 US disclosed
US-20100221214-A1 LINKED DIBENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2010-09-02 US disclosed
US-20100221214-A1 LINKED DIBENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2010-09-02 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 (7 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-20110300104-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 CTSG 456/4885CTRB1 466/4885PRSS1 1996/4885
US-20110250172-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 CTSG 456/4885CTRB1 466/4885PRSS1 1996/4885
US-20110142798-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 CTSG 456/4885CTRB1 466/4885PRSS1 1996/4885
US-20100226883-A1 LINKED DIIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 CTSG 2178/4885CTRB1 1330/4885PRSS1 3496/4885
US-20100221214-A1 LINKED DIBENZIMIDAZOLE DERIVATIVES EIF2AK2, NSUN2, ZC3HAV1 CTSG 2306/4885CTRB1 1326/4885PRSS1 3574/4885
US-20130295049-A1 LINKED DIBENZIMIDAZOLE ANTIVIRALS EIF2AK2, ZC3HAV1, NSUN2 CTSG 2133/4885CTRB1 1181/4885PRSS1 3550/4885
US-10752611-B2 Benzimidazole derivatives EIF2AK2, ZC3HAV1, ZC3HAV1L CTSG 1070/4885CTRB1 1414/4885PRSS1 2704/4885

“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.