SCHEMBL10366756

SCHEMBL10366756

CC1CCC(C2=C(c3cc(-c4ccc(N)cc4)sc3C(=O)OCCN(C)C)CCN(C)C2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 1/20 0.37
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
NPC1 O15118 5/20 0.32
MAPT P10636 5/20 0.32
RAB9A P51151 5/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 3/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
ALOX15 P16050 1/20 0.32
CHRM5 P08912 5/20 0.32
CHRM1 P11229 5/20 0.32
KDM4E B2RXH2 4/20 0.31
HPGD P15428 2/20 0.31
TP53 P04637 1/20 0.31
CASP3 P42574 1/20 0.31

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
SCHEMBL16866315 0.93 CHRM5 (0.35) CA1CA2MAPTKMT2AALDH1A1
SCHEMBL9975697 0.88 MAPT (0.39) NPC1MAPTRAB9AMEN1KMT2A
SCHEMBL10364872 0.86 DRD2 (0.35) CHRM1
SCHEMBL9975893 0.84 CHRM5 (0.30) CA1CA2CHRM5CHRM1
SCHEMBL9941862 0.84 ADRA2C (0.34) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL10324286 0.83 NAMPT (0.31)
SCHEMBL9975891 0.83
SCHEMBL16866369 0.80 MAPT (0.40) NPC1MAPTRAB9AMEN1KMT2A
SCHEMBL9975681 0.80 CHRM5 (0.40) NPC1MAPTRAB9AMEN1KMT2A
SCHEMBL9975909 0.79 SLC6A3 (0.37) NPC1MAPTRAB9AMEN1KMT2A

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-10426762-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL PHARMA, INC. (US) 2019-10-01 US disclosed
US-20170273962-A1 Inhibitors of Hepatitis C Virus Polymerase COCRYSTAL PHARMA, INC. 2017-09-28 US disclosed
US-20170273962-A1 Inhibitors of Hepatitis C Virus Polymerase COCRYSTAL PHARMA, INC. 2017-09-28 US disclosed
US-20140322165-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL DISCOVERY INC (US) 2014-10-30 US disclosed
US-20140322165-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL DISCOVERY INC (US) 2014-10-30 US disclosed
US-8771665-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL DISCOVERY, INC. (US) 2014-07-08 US disclosed
US-8771665-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL DISCOVERY, INC. (US) 2014-07-08 US disclosed
US-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL DISCOVERY, INC. (US) 2012-07-19 US disclosed
US-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL DISCOVERY, INC. (US) 2012-07-19 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 (4 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-10426762-B2 Inhibitors of hepatitis C virus polymerase POLR2E, POLR2H, GTF3C3 PHLPP2 2372/4885CA1 3680/4885CA2 1700/4885
US-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2A, POLR2B, POLR2E PHLPP2 3200/4885CA1 3751/4885CA2 2618/4885
US-20170273962-A1 Inhibitors of Hepatitis C Virus Polymerase POLR2E, POLR2H, GTF3C3 PHLPP2 2372/4885CA1 3680/4885CA2 1700/4885
US-20140322165-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2A, POLR2B, POLR2E PHLPP2 3200/4885CA1 3751/4885CA2 2618/4885

“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.