SCHEMBL10366121

SCHEMBL10366121

COCCc1nc2nc(C)cc(C)n2n1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.75
ALDH1A1 P00352 2/20 0.71
HTT P42858 1/20 0.71
TSHR P16473 1/20 0.54
KDM4E B2RXH2 3/20 0.54
PDE10A Q9Y233 13/20 0.53
HPGD P15428 2/20 0.49
CYP1A2 P05177 1/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL12844631 0.81 RECQL (0.83) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL10366120 0.79 ALDH1A1 (0.84) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL9975827 0.78 ALDH1A1 (0.70) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL15807121 0.78 RECQL (0.76) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL9975826 0.76 RECQL (0.73) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL4477888 0.76 RECQL (0.73) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL259219 0.76 RECQL (0.73) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL1464710 0.76 RECQL (0.73) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL15865967 0.74 KDM4E (0.76) RECQLALDH1A1HTTTSHRKDM4E
SCHEMBL12776201 0.73 RECQL (0.69) RECQLALDH1A1HTTTSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170273962-A1 Inhibitors of Hepatitis C Virus Polymerase COCRYSTAL PHARMA, INC. 2017-09-28 US disclosed
US-9707215-B2 Inhibitors of hepatitis C virus polymerase COCRYSTAL, DISCOVERY, INC. (US) 2017-07-18 US disclosed
US-20150182514-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE COCRYSTAL PHARMA, INC. 2015-07-02 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-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-20120183496-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2A, POLR2B, POLR2E RECQL 123/4885ALDH1A1 577/4885HTT 4482/4885
US-20150182514-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2E, POLR2H, GTF3C3 RECQL 146/4885ALDH1A1 743/4885HTT 4635/4885
US-20170273962-A1 Inhibitors of Hepatitis C Virus Polymerase POLR2E, POLR2H, GTF3C3 RECQL 146/4885ALDH1A1 743/4885HTT 4635/4885
US-20140322165-A1 INHIBITORS OF HEPATITIS C VIRUS POLYMERASE POLR2A, POLR2B, POLR2E RECQL 123/4885ALDH1A1 577/4885HTT 4482/4885

“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.