SCHEMBL3146384

SCHEMBL3146384

COc1cccc(-c2cncc(Nc3ccc(Cl)cn3)n2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.40
SLC2A1 P11166 1/20 0.39
CNR1 P21554 1/20 0.38
BRAF P15056 4/20 0.38
EGFR P00533 1/20 0.37
TNNI3K Q59H18 1/20 0.37
KDR P35968 4/20 0.37
MEN1 O00255 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KMT2A Q03164 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TGFBR1 P36897 2/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
JAK3 P52333 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36

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
SCHEMBL2892050 0.85 CNR1 (0.47) CNR1BRAFEGFRKDRTGFBR1
SCHEMBL3142551 0.82 KDR (0.41) BRAFKDRMEN1NPC1RAB9A
SCHEMBL3143142 0.78 SLC2A1 (0.61) PDE10ASLC2A1KDRMEN1NPC1
SCHEMBL3142884 0.75 BTK (0.51) CNR1KDRTGFBR1KDM4EBTK
SCHEMBL6658632 0.74 CDK2 (0.54) SLC2A1KDRMEN1NPC1RAB9A
SCHEMBL4898748 0.73 SLC2A1 (0.50) PDE10ASLC2A1EGFRTNNI3KKDR
SCHEMBL4901584 0.73 SLC2A1 (0.48) PDE10ASLC2A1EGFRTNNI3KKDR
SCHEMBL4892301 0.72 SLC2A1 (0.44) SLC2A1EGFRTNNI3KKDRMEN1
Hydrochloric Acid SCHEMBL4896691 0.72 SLC2A1 (0.47) PDE10ASLC2A1EGFRTNNI3KKDR
Hydrochloric Acid SCHEMBL4891120 0.69 SLC2A1 (0.62) PDE10ASLC2A1KDRMEN1NPC1

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
EP-1742935-B1 POLYCYCLIC PYRAZINES AS POTASSIUM ION CHANNEL MODULATORS ICAGEN INC (US) 2010-02-24 EP claimed
US-7642354-B2 Use treating nervous system disorders, as neuroprotectants, gastrointestinal disorders, cardiovascular disorders; e.g. 2-(5-phenylpyridin-2-ylamino)-6-pyridin-2-ylpyrimidine ICAGEN, INC. (US) 2010-01-05 US claimed
EP-1742935-B1 POLYCYCLIC PYRAZINES AS POTASSIUM ION CHANNEL MODULATORS ICAGEN INC (US) 2010-02-24 EP disclosed
US-7642354-B2 Use treating nervous system disorders, as neuroprotectants, gastrointestinal disorders, cardiovascular disorders; e.g. 2-(5-phenylpyridin-2-ylamino)-6-pyridin-2-ylpyrimidine ICAGEN, INC. (US) 2010-01-05 US disclosed
US-20050239800-A1 Polycyclic pyrazines as potassium ion channel modulators ICAGEN, INC. (US) 2005-10-27 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-20050239800-A1 Polycyclic pyrazines as potassium ion channel modulators KCNJ2, KCNH2, KCNJ1 PDE10A 2762/4885SLC2A1 1451/4885CNR1 942/4885

“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.