SCHEMBL13434871

SCHEMBL13434871

Cc1csc2c(Nc3ccc(C(=O)O)c(Cl)c3)ncnc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
MAPK1 P28482 2/20 0.48
NOD2 Q9HC29 1/20 0.48
RAF1 P04049 4/20 0.45
BRAF P15056 4/20 0.45
CSF1R P07333 3/20 0.45
DDR1 Q08345 3/20 0.45
DDR2 Q16832 3/20 0.45
LPAR1 Q92633 5/20 0.41
LPAR2 Q9HBW0 5/20 0.41
AURKA O14965 1/20 0.41
RPS6KB1 P23443 1/20 0.41
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL13434910 0.90 AURKA (0.49) MAPTMAPK1NOD2RAF1BRAF
SCHEMBL13434856 0.78 FADS1 (0.59) AURKANTRK1CSNK2A1
SCHEMBL4737834 0.76 FADS1 (0.60) MAPTMAPK1RAF1BRAFCSF1R
SCHEMBL13434869 0.76 F9 (0.52) MAPK1RAF1BRAFCSF1RDDR1
SCHEMBL29116330 0.75 MAPT (0.51) MAPTMAPK1LPAR1LPAR2MAPK14
SCHEMBL9930746 0.74 DHODH (0.49) MAPK1AURKARPS6KB1MAPK14MEN1
SCHEMBL4922291 0.72 SMN1; SMN2 (0.44) BRAFAURKARPS6KB1MEN1NPC1
SCHEMBL29116561 0.72 EGFR (0.60)
SCHEMBL7892355 0.71 KDR (0.52) MAPTMAPK1LPAR1LPAR2NPC1
SCHEMBL13402694 0.70 EGFR (0.62) AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633201-B2 Thienopyrimidines having Mnk1/Mnk2 inhibiting activity for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
US-8633201-B2 Thienopyrimidines having Mnk1/Mnk2 inhibiting activity for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-21 US disclosed
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-03-04 US disclosed
US-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-03-04 US disclosed
WO-2007115822-A1 THIENOPYRIMIDINES HAVING MNKL /MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2007-10-18 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-20100056548-A1 THIENOPYRIMIDINES HAVING MNK1/MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS CMPK1, DTYMK, NEK9 MAPT 1829/4885MAPK1 483/4885NOD2 2042/4885

“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.