SCHEMBL8909675

SCHEMBL8909675

CC(C)(C)C(=O)[C@@H](c1ccccc1)N1CCC(c2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
PRCP P42785 1/20 0.45
OPRM1 P35372 1/20 0.44
LMNA P02545 2/20 0.44
CYP3A4 P08684 1/20 0.44
HIF1A Q16665 1/20 0.44
RIPK1 Q13546 2/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SLC18A3 Q16572 3/20 0.42
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42

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
SCHEMBL8909664 0.86 LMNA (0.46) OPRM1LMNACYP3A4HIF1AGAA
SCHEMBL12175058 0.84 KCNH2 (0.52) KCNH2HRH3PRCPOPRM1LMNA
SCHEMBL890109 0.84 KCNH2 (0.52) KCNH2HRH3PRCPOPRM1LMNA
SCHEMBL753850 0.84 LMNA (0.63) KCNH2HRH3PRCPOPRM1LMNA
SCHEMBL15429939 0.82 LMNA (0.65) KCNH2LMNACYP3A4HIF1AGAA
SCHEMBL8906984 0.82 LMNA (0.65) KCNH2LMNACYP3A4HIF1AGAA
SCHEMBL12158639 0.82 KCNH2 (0.53) KCNH2HRH3PRCPOPRM1LMNA
SCHEMBL888843 0.82 KCNH2 (0.53) KCNH2HRH3PRCPOPRM1LMNA
SCHEMBL8907109 0.81 GAA (0.66) KCNH2LMNACYP3A4HIF1AGAA
SCHEMBL8906962 0.81 DPP4 (0.44) LMNACYP3A4HIF1ARIPK1GAA

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 9 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-8673954-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2014-03-18 US disclosed
US-8637561-B2 Linked diimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2014-01-28 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-20120076756-A1 NOVEL BENZIMIDAZOLE DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2012-03-29 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

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-20120076756-A1 NOVEL BENZIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 KCNH2 3278/4885HRH3 3208/4885PRCP 1337/4885
US-20100226883-A1 LINKED DIIMIDAZOLE DERIVATIVES EIF2AK2, ZC3HAV1, HAVCR2 KCNH2 3093/4885HRH3 3685/4885PRCP 1255/4885
US-20100221214-A1 LINKED DIBENZIMIDAZOLE DERIVATIVES EIF2AK2, NSUN2, ZC3HAV1 KCNH2 3860/4885HRH3 3578/4885PRCP 1178/4885
US-20130295049-A1 LINKED DIBENZIMIDAZOLE ANTIVIRALS EIF2AK2, ZC3HAV1, NSUN2 KCNH2 3812/4885HRH3 3341/4885PRCP 1075/4885
US-10752611-B2 Benzimidazole derivatives EIF2AK2, ZC3HAV1, ZC3HAV1L KCNH2 3068/4885HRH3 3216/4885PRCP 1292/4885

“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.