SCHEMBL13120672

SCHEMBL13120672

Cc1nc2ccc3ccncc3c2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 7/20 0.41
▸ MAPK10 P53779 4/20 0.39
▸ CDC7 O00311 1/20 0.37
▸ DBF4 Q9UBU7 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ CLK1 P49759 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ TNKS2 Q9H2K2 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ GMNN O75496 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35

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
SCHEMBL10644678 0.77 TYMS (0.60) TYMSALDH1A1PARP1TNKS2KDM4E
SCHEMBL12328336 0.76 PARP1 (0.35) TYMSCDC7DBF4ALDH1A1PARP1
SCHEMBL12328107 0.75 TYMS (0.46) TYMSALDH1A1PARP1KDM4ELMNA
SCHEMBL13561693 0.75 IL5 (0.41) TYMSALDH1A1PARP1TNKS2KDM4E
SCHEMBL13383928 0.74 ALDH1A1 (0.48) TYMSALDH1A1PARP1TNKS2KDM4E
SCHEMBL13383924 0.71 TYMS (0.44) TYMSALDH1A1PARP1TNKS2KDM4E
SCHEMBL2756731 0.70 CYP1A2 (0.44) TYMSALDH1A1KDM4ELMNACYP1A2
SCHEMBL4068173 0.70 MAPK10 (0.40) MAPK10ACHECLK1DYRK1AKDM4E
SCHEMBL12102095 0.70 PARP1 (0.61) TYMSCDC7DBF4KDM4CALDH1A1
SCHEMBL30617074 0.70 KDM4A (0.46) MAPK10KDM4CCLK1DYRK1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096725-B2 Cross-linked polyazole, method of preparing the polyazole, electrode for fuel cell including the cross-linked polyazole, electrolyte membrane for fuel cell including the cross-linked polyazole, method of manufacturing the electrolyte membrane, and fuel cell including the cross-linked polyazole SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-08-04 — — US disclosed
US-9096725-B2 Cross-linked polyazole, method of preparing the polyazole, electrode for fuel cell including the cross-linked polyazole, electrolyte membrane for fuel cell including the cross-linked polyazole, method of manufacturing the electrolyte membrane, and fuel cell including the cross-linked polyazole SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-08-04 — — US disclosed
US-20100273087-A1 CROSS-LINKED POLYAZOLE, METHOD OF PREPARING THE POLYAZOLE, ELECTRODE FOR FUEL CELL INCLUDING THE CROSS-LINKED POLYAZOLE, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE CROSS-LINKED POLYAZOLE, METHOD OF MANUFACTURING THE ELECTROLYTE MEMBRANE, AND FUEL CELL INCLUDING THE CROSS-LINKED POLYAZOLE SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-10-28 — — US disclosed
US-20100273087-A1 CROSS-LINKED POLYAZOLE, METHOD OF PREPARING THE POLYAZOLE, ELECTRODE FOR FUEL CELL INCLUDING THE CROSS-LINKED POLYAZOLE, ELECTROLYTE MEMBRANE FOR FUEL CELL INCLUDING THE CROSS-LINKED POLYAZOLE, METHOD OF MANUFACTURING THE ELECTROLYTE MEMBRANE, AND FUEL CELL INCLUDING THE CROSS-LINKED POLYAZOLE SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-10-28 — — US disclosed
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