SCHEMBL12426319

SCHEMBL12426319

Cc1cc2c(Cl)nc(-c3cccc(Cl)c3)nc2o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.55
RAB9A P51151 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
MEN1 O00255 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 1/20 0.55
NR1I3 Q14994 1/20 0.43
DHPS P49366 1/20 0.41
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40
EGFR P00533 1/20 0.40
KDR P35968 1/20 0.40
TSHR P16473 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
MAOB P27338 1/20 0.39
IDH1 O75874 1/20 0.39
IDO1 P14902 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL12509853 0.89 RAB9A (0.55) NPC1RAB9ASMN1; SMN2MEN1HTT
SCHEMBL14461916 0.83 RAB9A (0.49) NPC1RAB9ASMN1; SMN2MEN1HTT
SCHEMBL12426159 0.78 TGFBR1 (0.64) NPC1RAB9ASMN1; SMN2MEN1HTT
SCHEMBL12426337 0.77 DHPS (0.41) NPC1RAB9ASMN1; SMN2NR1I3DHPS
SCHEMBL12426299 0.73 MAPT (0.45) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL12426318 0.73 TNKS (0.48) NPC1RAB9ASMN1; SMN2MEN1HTT
SCHEMBL10589866 0.72 IDO1 (0.57) NPC1RAB9ASMN1; SMN2NR1I3TP53
SCHEMBL8357919 0.71 DHFR (0.52) NR1I3DHPSTP53MAPTIDH1
SCHEMBL31044873 0.71 ADORA2A (0.43) KMT2ANR1I3DHPSTP53MAPT
SCHEMBL3124020 0.71 KDR (0.54) NPC1RAB9ASMN1; SMN2MEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977342-B2 HCV inhibiting bi-cyclic pyrimidines TIBOTEC-VIRCO VIROLOGY BVBA (BE) 2011-07-12 US disclosed
US-7977342-B2 HCV inhibiting bi-cyclic pyrimidines TIBOTEC-VIRCO VIROLOGY BVBA (BE) 2011-07-12 US disclosed
US-20070155716-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-07-05 US disclosed
US-20070155716-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-07-05 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 (1 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-20070155716-A1 HCV INHIBITING BI-CYCLIC PYRIMIDINES UMPS, NUDT1, PNP NPC1 2421/4885RAB9A 2932/4885SMN1; SMN2 4514/4885

“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.