SCHEMBL13434860

SCHEMBL13434860

c1nc(Nc2ccc3[nH]ncc3c2)c2sccc2n1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 5/20 0.69
▸ FLT1 P17948 2/20 0.69
▸ MKNK1 Q9BUB5 8/20 0.62
▸ RET P07949 1/20 0.57
▸ ROCK2 O75116 3/20 0.56
▸ FADS1 O60427 1/20 0.54
▸ PIP4K2C Q8TBX8 1/20 0.50
▸ ROCK1 Q13464 1/20 0.50
▸ CDC7 O00311 1/20 0.50

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
SCHEMBL30611478 1.00 EGFR (0.69) EGFRFLT1MKNK1RETROCK2
SCHEMBL22946710 0.90 EGFR (0.62) EGFRFLT1MKNK1RETROCK2
SCHEMBL3035598 0.82 ROCK2 (0.60) EGFRFLT1MKNK1RETROCK2
SCHEMBL5461595 0.81 EGFR (1.00) EGFRFLT1FADS1PIP4K2C
SCHEMBL30611453 0.81 MKNK1 (0.69) EGFRFLT1MKNK1RETROCK2
SCHEMBL4035154 0.79 MKNK1 (0.55) EGFRFLT1MKNK1RETROCK2
SCHEMBL13220437 0.78 ROCK2 (0.54) EGFRFLT1MKNK1ROCK2ROCK1
SCHEMBL13434870 0.78 MKNK1 (0.60) EGFRFLT1MKNK1RETCDC7
SCHEMBL2835747 0.78 EGFR (0.74) EGFRFLT1MKNK1RETROCK2
SCHEMBL29516907 0.78 EGFR (0.74) EGFRFLT1MKNK1RETROCK2

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 EGFR 4110/4885FLT1 3883/4885MKNK1 29/4885

“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.

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