SCHEMBL8915495

SCHEMBL8915495

CCC(=O)C(NC(=O)OC)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 6/20 0.52
CYP2D6 P10635 5/20 0.52
CYP2C9 P11712 4/20 0.52
CYP3A4 P08684 3/20 0.52
ALDH1A1 P00352 2/20 0.52
OPRK1 P41145 1/20 0.48
ATM Q13315 1/20 0.48
TSHR P16473 2/20 0.45
CTSS P25774 2/20 0.45
CTSK P43235 1/20 0.45
KMT2A Q03164 3/20 0.44
MAPT P10636 1/20 0.44
CTSL P07711 1/20 0.44
MEN1 O00255 2/20 0.43
CYP1A2 P05177 1/20 0.42
ALOX15 P16050 1/20 0.42
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL7605378 1.00 CYP2C19 (0.52) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL12280622 1.00 CYP2C19 (0.52) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL21142858 0.83 LMNA (0.51) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL13545121 0.83 MTNR1A (0.46) ALDH1A1KMT2AMEN1CYP1A2LMNA
SCHEMBL5743537 0.83 LMNA (0.51) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL194384 0.82 ATM (0.60) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL193009 0.82 ATM (0.60) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL203326 0.82 ATM (0.60) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL19334132 0.82 ASAH1 (0.51) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1
SCHEMBL3265138 0.81 CYP2C19 (0.56) CYP2C19CYP2D6CYP2C9CYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285378-A1 Anti-Viral Compounds ABBVIE INC. (US) 2023-09-14 US disclosed
EP-2678334-B1 ANTI-VIRAL COMPOUNDS ABBVIE BAHAMAS LTD (BS) 2017-03-22 EP disclosed
EP-2692346-B1 An antiviral 1-phenyl-2,5-dibenzimidazol-5-yl-pyrrolidine derivative ABBVIE BAHAMAS LTD (BS) 2015-12-02 EP disclosed
EP-2692346-A1 An antiviral 1-phenyl-2,5-dibenzimidazol-5-yl-pyrrolidine derivative Abbvie Inc. (US) 2014-02-05 EP disclosed
EP-2368890-B9 Hepatitis C virus inhibitors ABBVIE BAHAMAS LTD (BS) 2013-10-30 EP disclosed
EP-2628481-A1 Trisubstituted heterocycles as replication inhibitors of hepatitis C virus HCV AbbVie Bahamas Ltd. (BS) 2013-08-21 EP disclosed
EP-2368890-B1 Hepatitis C virus inhibitors ABBVIE BAHAMAS LTD (BS) 2013-04-17 EP disclosed
US-8188132-B2 Linked dibenzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
WO-2010138791-A1 ANTIVIRAL COMPOUNDS COMPOSED OF THREE LINKED ARYL MOIETIES TO TREAT DISEASES SUCH AS HEPATITIS C SCHERING CORPORATION (US) 2010-12-02 WO 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 (2 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-20230285378-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS CYP2C19 4120/4885CYP2D6 3539/4885CYP2C9 3780/4885
US-20100221214-A1 LINKED DIBENZIMIDAZOLE DERIVATIVES EIF2AK2, NSUN2, ZC3HAV1 CYP2C19 392/4885CYP2D6 478/4885CYP2C9 412/4885

“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.