SCHEMBL1721310

SCHEMBL1721310

NC(=O)c1ncc2nc[nH]c2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GDA Q9Y2T3 1/20 0.39
▸ SYK P43405 1/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ PARP1 P09874 1/20 0.33
▸ RIPK1 Q13546 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ LMNA P02545 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ MMP9 P14780 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CCNT1 O60563 1/20 0.31
▸ CCND1 P24385 1/20 0.31
▸ CCNC P24863 1/20 0.31

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
SCHEMBL4436717 0.84 HSD17B10 (0.33) GDAHDAC6KDM4EALDH1A1SMN1; SMN2
SCHEMBL5349497 0.84 HDAC6 (0.36) SYKHDAC6KDM4EALDH1A1SMN1; SMN2
SCHEMBL31269349 0.84 HSD17B10 (0.33) GDAHDAC6KDM4EALDH1A1SMN1; SMN2
SCHEMBL6046332 0.82 KDM4E (0.31) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL7771667 0.82 SLC2A1 (0.37) GDASYKHDAC6KDM4EALDH1A1
SCHEMBL4520168 0.82 HDAC6 (0.32) HDAC6KDM4EALDH1A1GLAGAA
SCHEMBL27486869 0.79 ABL1 (0.36) MAPK1TSHRKDM4EALDH1A1HPGD
SCHEMBL6060475 0.78 CTNNB1 (0.30) —
SCHEMBL23409493 0.75 HTT (0.39) GDASYKHSD17B10
SCHEMBL30842861 0.75 HTT (0.39) GDASYKHSD17B10

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2405917-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS Advinus Therapeutics Private Limited (IN) 2012-01-18 — — EP claimed
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 — — WO claimed
JP-4184279-B2 — — 2008-11-19 — — JP claimed
EP-1255764-B8 PURINE DERIVATIVES PFIZER LTD (GB) 2006-06-28 — — EP claimed
JP-2005513043-A — — 2005-05-12 — — JP claimed
EP-1456219-A1 Crystalline form of a ribofuranosyluronamide derivative; a human adenosine A2a receptor agonist Pfizer Limited (GB) 2004-09-15 — — EP claimed
JP-2004508284-A — — 2004-03-18 — — JP claimed
EP-1397140-A2 COMBINATION OF AN ADENOSINE A2A-RECEPTOR AGONIST AND TIOTROPIUM OR A DERIVATIVE THEREOF FOR TREATING OBSTRUCTIVE AIRWAYS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2004-03-17 — — EP claimed
WO-2003047597-A1 COMBINATION OF CRYSTALLINE FORM OF A RIBOFURANOSYLURONAMIDE DERIVATIVE AND TIOTROPIUM SALT PFIZER LIMITED (GB) 2003-06-12 — — WO claimed
WO-2003048180-A1 CRYSTALLINE FORM OF A RIBOFURANOSYLURONAMIDE DERIVATIVE; A HUMAN ADENOSINE A2A RECEPTOR AGONIST PFIZER LIMITED (GB) 2003-06-12 — — WO claimed
WO-2002094273-A2 COMBINATION OF AN ADENOSINE A2A-RECEPTOR AGONIST AND TIOTROPIUM OR A DERIVATIVE THEREOF FOR TREATING OBSTRUCTIVE AIRWAYS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-11-28 — — WO claimed
EP-1255764-A1 PURINE DERIVATIVES PFIZER INC. (US) 2002-11-13 — — EP claimed
EP-1185542-A2 PURINE DERIVATIVES Pfizer Limited (GB) 2002-03-13 — — EP claimed
WO-2001060835-A1 PURINE DERIVATIVES PFIZER LIMITED (GB) 2001-08-23 — — WO claimed
WO-2000077018-A2 PURINE DERIVATIVES PFIZER LIMITED (GB) 2000-12-21 — — WO claimed
EP-2405917-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS Advinus Therapeutics Private Limited (IN) 2012-01-18 — — EP disclosed
WO-2010103547-A2 SUBSTITUTED FUSED PYRIMIDINE COMPOUNDS ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-09-16 — — WO disclosed
WO-2002022630-A1 PURINE DERIVATIVES PFIZER LIMITED (GB) 2002-03-21 — — WO disclosed
WO-2001094368-A1 2-AMINOCARBONYL-9H-PURINE DERIVATIVES PFIZER LIMITED (GB) 2001-12-13 — — WO disclosed
WO-2001060835-A1 PURINE DERIVATIVES PFIZER LIMITED (GB) 2001-08-23 — — WO disclosed
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