SCHEMBL1643065

SCHEMBL1643065

Cc1nc2cc(Nc3cncc(Cl)n3)ccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.59
▸ CDK2 P24941 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ TP53 P04637 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ RAB9A P51151 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.42
▸ PKM P14618 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ HSD17B10 Q99714 3/20 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
SCHEMBL1642752 0.81 KMT2A (0.66) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL1642722 0.77 CDK2 (0.50) CDK2
SCHEMBL7022198 0.72 KMT2A (0.64) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL30574121 0.71 MAPT (0.62) CDK2MAPT
SCHEMBL25699280 0.70 KMT2A (0.62) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL16860869 0.70 KMT2A (0.62) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL2885798 0.70 CDK2 (0.73) CDK2RAB9ANPC1MAPT
SCHEMBL8139970 0.69 KMT2A (0.50) KMT2ACDK2
Hydrochloric Acid SCHEMBL28888276 0.69 KMT2A (0.60) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL15174493 0.69 KMT2A (0.50) KMT2AKDM4EMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2671876-A2 Pyrazine derivatives and their use as protein kinase inhbitors Akinion Pharmaceuticals AB (SE) 2013-12-11 — — EP disclosed
US-20130203774-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF AKINION PHARMACEUTICALS AB (SE) 2013-08-08 — — US disclosed
CN-101970418-B Pyrazine derivative and its uses as protein kinase inhibitor AKINION PHARMACEUTICALS AB 2013-07-03 — — CN disclosed
US-8436171-B2 Amino substituted pyrazines as inhibitors or protein kinases AKINION PHARMACEUTICALS AB (SE) 2013-05-07 — — US disclosed
US-20110098310-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF BIOVITRUM AB (SE) 2011-04-28 — — US disclosed
CN-101970418-A Novel compounds, use and preparation thereof AKINION PHARMACEUTICALS AB 2011-02-09 — — CN disclosed
EP-2252597-A2 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF Akinion Pharmaceuticals AB (SE) 2010-11-24 — — EP disclosed
WO-2009095399-A2 PYRAZINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHBITORS AKINION PHARMACEUTICALS AB (SE) 2009-08-06 — — 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 (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-20130203774-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF FLT3, MLLT1, MYD88 KMT2A 114/4885CDK2 93/4885KDM4E 597/4885
US-20110098310-A1 NOVEL COMPOUNDS, USE AND PREPARATION THEREOF FLT3, MLLT1, MYD88 KMT2A 114/4885CDK2 93/4885KDM4E 597/4885

“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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