SCHEMBL19851076

SCHEMBL19851076

Sc1nc2cnccc2n1-c1ccccccccc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 3/20 0.52
ALDH1A1 P00352 2/20 0.49
FGFR1 P11362 1/20 0.49
ATM Q13315 1/20 0.46
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
CASP1 P29466 1/20 0.38
RAB9A P51151 1/20 0.38
AOC3 Q16853 2/20 0.37

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
SCHEMBL16332838 1.00 RPS6KA5 (0.52) RPS6KA5ALDH1A1FGFR1ATMMAPK1
SCHEMBL889831 0.80 MAPK1 (0.61) ALDH1A1ATMMAPK1HTTKDM4E
SCHEMBL540767 0.80 MAPK1 (0.67) RPS6KA5ALDH1A1ATMMAPK1HTT
SCHEMBL16054504 0.80 RPS6KA5 (0.52) RPS6KA5ALDH1A1FGFR1ATMMAPK1
SCHEMBL27949768 0.79 MAPK1 (0.59) ALDH1A1ATMMAPK1HTTKDM4E
SCHEMBL10247453 0.79 ATM (0.65) RPS6KA5ALDH1A1FGFR1ATMHTT
SCHEMBL14420337 0.79 GSR (0.52) ALDH1A1MAPK1HTTKDM4ENPC1
SCHEMBL24477016 0.76 RPS6KA5 (0.49) RPS6KA5ALDH1A1FGFR1ATMMAPK1
SCHEMBL11901799 0.76 RPS6KA5 (0.49) RPS6KA5ALDH1A1FGFR1ATMMAPK1
SCHEMBL16035164 0.76 RPS6KA5 (0.49) RPS6KA5ALDH1A1FGFR1ATMMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399978-B2 Imidazopyridine thioglycolic acid derivatives as potent inhibitors of human urate transporter 1 SHANDONG UNIVERSITY (CN) 2019-09-03 US disclosed
EP-3495362-A1 IMIDAZOPYRIDINE THIOGLYCOLIC ACID DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shandong University (CN) 2019-06-12 EP disclosed
WO-2018023851-A1 IMIDAZOPYRIDINE THIOGLYCOLIC ACID DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 山东大学 2018-02-08 WO 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-10399978-B2 Imidazopyridine thioglycolic acid derivatives as potent inhibitors of human urate transporter 1 SLC29A1, SLC28A1, SLC5A1 RPS6KA5 4353/4885ALDH1A1 473/4885FGFR1 403/4885

“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.