SCHEMBL13035474

SCHEMBL13035474

Clc1nccc(Nc2ccc3ncsc3c2)n1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.52
SYK P43405 1/20 0.51
KDR P35968 1/20 0.48
LRRK2 Q5S007 1/20 0.47
IKBKB O14920 11/20 0.46
CHUK O15111 3/20 0.46
IRAK4 Q9NWZ3 1/20 0.45
PRKD1 Q15139 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
RIPK1 Q13546 1/20 0.43

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
SCHEMBL13035473 0.81 SYK (0.64) PLK1SYKKDRIKBKBCHUK
SCHEMBL6394544 0.78 KDR (0.67) PLK1SYKKDRIKBKBCHUK
SCHEMBL6312915 0.78 IGF1R (0.52) SYKKDRMEN1NPC1RAB9A
SCHEMBL4017779 0.76 NPC1 (0.50) SYKKDRLRRK2IRAK4MEN1
SCHEMBL17484071 0.75 KDR (0.59) PLK1SYKKDRIKBKBCHUK
SCHEMBL3388994 0.74 IGF1R (0.55) MEN1NPC1RAB9AKMT2A
SCHEMBL17801752 0.73 SYK (0.69) PLK1SYKKDRLRRK2IKBKB
SCHEMBL19836328 0.72 DYRK1A (0.51) SYKIKBKBCHUKRIPK1
SCHEMBL6317977 0.72 IGF1R (0.57) RAB9A
SCHEMBL6311516 0.72 KDM1A (0.49) MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298314-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-11-25 US disclosed
US-20100298314-A1 NOVEL JNK INHIBITORS SCHERING CORPORATION 2010-11-25 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-20100298314-A1 NOVEL JNK INHIBITORS MAPK1, MAPKAPK2, MAP4K2 PLK1 685/4885SYK 1187/4885KDR 2419/4885

“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.