SCHEMBL7576503

SCHEMBL7576503

Cc1cnc(C#N)c(C)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.34
JAK3 P52333 1/20 0.34
CHEK1 O14757 1/20 0.32
ABL1 P00519 1/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
FLT1 P17948 1/20 0.32
GRK5 P34947 1/20 0.32
KDR P35968 1/20 0.32
MAP2K2 P36507 1/20 0.32
CDK8 P49336 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
PRKX P51817 1/20 0.32
NEK2 P51955 1/20 0.32
LIMK1 P53667 1/20 0.32
MAP2K1 Q02750 1/20 0.32
PRKCQ Q04759 1/20 0.32

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
SCHEMBL1617515 0.84 MAPT (0.37) KDM4EALDH1A1POLBCHEK1ABL1
SCHEMBL13082119 0.82 KDM5A (0.32) KDM4EALDH1A1POLBJAK3CHEK1
SCHEMBL30826009 0.78 ALDH1A1 (0.40) KDM4EALDH1A1POLBCHEK1ABL1
SCHEMBL15142766 0.78 PIK3CD (0.40) KDM4EALDH1A1POLBCLK4PIK3CD
SCHEMBL8896520 0.78 KDM4E (0.46) KDM4EALDH1A1POLBCLK4PIK3CD
SCHEMBL23509034 0.78 HPGD (0.33) KDM4EALDH1A1POLBJAK3CHEK1
SCHEMBL8139272 0.78 KDM4E (0.40) KDM4EALDH1A1POLBJAK3CLK4
SCHEMBL2614511 0.78 CYP11B1 (0.35) KDM4EALDH1A1POLBJAK3CHEK1
SCHEMBL14932502 0.78 PIK3CD (0.33) KDM4EALDH1A1POLBCHEK1ABL1
SCHEMBL18296394 0.78 ALDH1A1 (0.40) KDM4EALDH1A1POLBCHEK1ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11647671-B2 Compound and organic electro-optical device containing the same WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2023-05-09 US disclosed
US-20230012570-A1 BICYCLIC COMPOUND USED AS SELECTIVE ANDROGEN RECEPTOR MODULATOR MEDSHINE DISCOVERY INC. (CN) 2023-01-19 US disclosed
US-20160175304-A1 N-[4-(1H-PYRAZOLO[3,4-b]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2016-06-23 US disclosed
US-9221828-B2 N-[4-(1H-pyrazolo[3,4-b]pyrazin-6-yl)phenyl]sulfonamides as pharmaceuticals SANOFI (FR) 2015-12-29 US disclosed
US-9174993-B2 N-[4-(1H-pyrazolo[3,4-b]pyrazin-6-yl)-phenyl]-sulfonamides and their use as pharmaceuticals SANOFI (FR) 2015-11-03 US disclosed
US-20140357640-A1 N-[4-(1H-PYRAZOLO[3,4-B]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2014-12-04 US disclosed
US-20140288083-A1 N-[4-(1H-PYRAZOLO[3,4-B]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2014-09-25 US disclosed
US-20130072493-A1 N-[4-(1H-PYRAZOLO[3,4-b]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2013-03-21 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
EP-1970373-A1 ALICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-09-17 EP disclosed
EP-0680955-B1 PROCESS FOR PRODUCING N-tert-BUTYL-2-PYRAZINECARBOXAMIDE AND N-tert-BUTYL-2-PIPERAZINECARBOXAMIDE KOEI CHEMICAL CO (JP) 2002-09-18 EP disclosed
US-5922873-A Process for preparing N-tert-butyl-2-pyrazinecarboxamide and N-tert-butyl-2-piperazinecarboxamide KOEI CHEMICAL CO., LTD. (JP) 1999-07-13 US disclosed
US-5734055-A Process for preparing N-tert-butyl-2-pyrazinecarboxamide and N-tert-butyl-2-piperazinecarboxamide KOEI CHEMICAL CO. LTD. (JP) 1998-03-31 US disclosed
EP-0680955-A1 PROCESS FOR PRODUCING N-tert-BUTYL-2-PYRAZINECARBOXAMIDE AND N-tert-BUTYL-2-PIPERAZINECARBOXAMIDE KOEI CHEMICAL CO., LTD. (JP) 1995-11-08 EP disclosed
EP-0111160-B1 PROCESS FOR THE PREPARATION OF 2-HALOGEN AND 2-CYANO PYRAZINES BASF Aktiengesellschaft (DE) 1986-10-22 EP disclosed
EP-0111160-A1 Process for the preparation of 2-halogen and 2-cyano pyrazines BASF Aktiengesellschaft (DE) 1984-06-20 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 (7 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-20130072493-A1 N-[4-(1H-PYRAZOLO[3,4-b]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SGK1, SGK3, SGK2 KDM4E 2910/4885ALDH1A1 2371/4885POLB 4551/4885
US-20090182140-A1 Alicyclic Heterocyclic Compound CCR4, CCR1, HRH4 KDM4E 657/4885ALDH1A1 1767/4885POLB 3362/4885
US-11647671-B2 Compound and organic electro-optical device containing the same EPCAM, LPO, CYBA KDM4E 507/4885ALDH1A1 1369/4885POLB 1647/4885
US-20160175304-A1 N-[4-(1H-PYRAZOLO[3,4-b]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SGK1, SGK3, SGK2 KDM4E 2910/4885ALDH1A1 2371/4885POLB 4551/4885
US-20140357640-A1 N-[4-(1H-PYRAZOLO[3,4-B]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SGK3, SGK1, SGK2 KDM4E 3378/4885ALDH1A1 2508/4885POLB 4508/4885
US-20230012570-A1 BICYCLIC COMPOUND USED AS SELECTIVE ANDROGEN RECEPTOR MODULATOR AR, NR5A1, CYP17A1 KDM4E 1483/4885ALDH1A1 936/4885POLB 4200/4885
US-20140288083-A1 N-[4-(1H-PYRAZOLO[3,4-B]PYRAZIN-6-YL)-PHENYL]-SULFONAMIDES AND THEIR USE AS PHARMACEUTICALS SGK1, SGK3, SGK2 KDM4E 2910/4885ALDH1A1 2371/4885POLB 4551/4885

“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.