SCHEMBL2642887

SCHEMBL2642887

[NH]c1nc2cccnc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.58
POLB P06746 2/20 0.50
NPC1 O15118 13/20 0.45
RAB9A P51151 10/20 0.45
SMN1; SMN2 Q16637 7/20 0.45
ALDH1A1 P00352 9/20 0.41
KDM4E B2RXH2 8/20 0.39
GLA P06280 3/20 0.39
RUNX1 Q01196 3/20 0.39
CBFB Q13951 3/20 0.39
GAA P10253 3/20 0.39
CYP2A6 P11509 2/20 0.38
HPGD P15428 5/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
TSHR P16473 3/20 0.37
HSD17B10 Q99714 3/20 0.37
CASP7 P55210 1/20 0.37
LMNA P02545 3/20 0.36
HTT P42858 3/20 0.36

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
SCHEMBL30190003 0.77 PDK1 (0.60) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL140126 0.77 PDK1 (0.60) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL2176039 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL369133 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL29390917 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL13310867 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL1761326 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL137507 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL15689525 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2
SCHEMBL28604628 0.75 PDK1 (0.58) PDK1POLBNPC1RAB9ASMN1; SMN2

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-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2024-06-25 US claimed
EP-3810606-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2021-04-28 EP claimed
WO-2019243550-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2019-12-26 WO claimed
US-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE UCB Biopharma SRL (BE) 2024-06-25 US disclosed
EP-3810606-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2021-04-28 EP disclosed
WO-2019243550-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2019-12-26 WO disclosed
US-7687502-B2 Substituted quinazoline or pyridopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-03-30 US disclosed
US-20080032996-A1 Substituted Quinazoline or Pyridopyrimidine Derivative MSD K.K. (JP) 2008-02-07 US disclosed
EP-1734040-A1 SUBSTITUTED QUINAZOLINE OR PYRIDOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-12-20 EP 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 (2 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-12018021-B2 Thiophene derivatives for the treatment of disorders caused by IgE TSLP, CYSLTR1, CYSLTR2 PDK1 3774/4885POLB 3826/4885NPC1 185/4885
US-20080032996-A1 Substituted Quinazoline or Pyridopyrimidine Derivative GCK, GCKR, PDXK PDK1 42/4885POLB 3158/4885NPC1 3557/4885

“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.