SCHEMBL1744852

SCHEMBL1744852

CNc1cc(-c2ccccc2)cnc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.49
USP7 Q93009 1/20 0.49
MAPT P10636 1/20 0.47
CASP1 P29466 1/20 0.47
LDHA P00338 1/20 0.47
LDHB P07195 1/20 0.47
PIK3CG P48736 2/20 0.47
FYN P06241 2/20 0.47
GSK3B P49841 5/20 0.46
MKNK1 Q9BUB5 2/20 0.44
CHEK2 O96017 1/20 0.44
PRKCI P41743 1/20 0.43
PDPK1 O15530 1/20 0.42
CDK1 P06493 1/20 0.42
CDK2 P24941 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
GSK3A P49840 1/20 0.41
AXL P30530 1/20 0.41
CDK8 P49336 1/20 0.41
PIK3CD O00329 1/20 0.41

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
SCHEMBL11230514 0.84 AURKA (0.49) PIK3CGFYNGSK3BCHEK2PRKCI
Dimethylamine SCHEMBL2972047 0.80 MAPT (0.57) MAP4K4USP7MAPTCASP1FYN
SCHEMBL29361094 0.76 MAP4K4 (0.71) MAP4K4USP7MAPTCASP1FYN
SCHEMBL15785404 0.76 MAP4K4 (0.71) MAP4K4USP7MAPTCASP1FYN
SCHEMBL19400776 0.75 MAPT (0.56) MAP4K4USP7MAPTCASP1FYN
SCHEMBL709795 0.75 MAPT (0.59) MAP4K4USP7MAPTCASP1FYN
SCHEMBL971373 0.73 MAP4K4 (0.80) MAP4K4USP7FYNMKNK1CHEK2
SCHEMBL3647945 0.72 MAP4K4 (0.62) MAP4K4USP7MAPTCASP1FYN
SCHEMBL3596246 0.72 MAP4K4 (0.53) MAP4K4USP7MAPTCASP1FYN
SCHEMBL488494 0.72 USP7 (0.62) MAP4K4USP7MAPTCASP1FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101495464-B Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV 2014-03-05 CN claimed
CN-103396398-A Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV 2013-11-20 CN claimed
CN-101495464-A Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2009-07-29 CN claimed
CN-101405002-A Prokineticin 2 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2009-04-08 CN claimed
JP-11071372-A None JP disclosed
EP-2385042-B1 Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2015-11-25 EP disclosed
CN-101495464-B Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV 2014-03-05 CN disclosed
CN-103396398-A Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV 2013-11-20 CN disclosed
EP-1973886-B1 PROKINETICIN 1 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2013-02-27 EP disclosed
EP-2385042-A1 Prokineticin 1 receptor antagonists Janssen Pharmaceutica N.V. (BE) 2011-11-09 EP disclosed
US-8039028-B2 Use of an extract of the orchid Vanda coerulea as a skin hydrating agent LVMH REACHERCHE (FR) 2011-10-18 US disclosed
CN-101495464-A Prokineticin 1 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2009-07-29 CN disclosed
CN-101405002-A Prokineticin 2 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2009-04-08 CN disclosed
JP-2000154189-A 2-ALKOXYCARBONYLAMINO-1-METHYL-6-PHENYLIMIDAZO[4,5- B]PYRIDINE DERIVATIVE AND SYNTHESIS OF 2-AMINO-1-METHYL-6- PHENYLIMIDAZO[4,5-B]PYRIDINE USING THE SAME DERIVATIVE MORINAGA MILK IND CO LTD 2000-06-06 JP disclosed
JP-2000154188-A 2-BENZOYLAMINO-1-METHYL-6-PHENYLIMIDAZO [4,5-B]PYRIDINE DERIVATIVE AND SYNTHESIS OF 2-AMINO-1-METHYL-6- PHENYLIMIDAZO[4,5-B]PYRIDINE USING THE SAME DERIVATIVE MORINAGA MILK IND CO LTD 2000-06-06 JP disclosed
JP-H1171372-A SYNTHESIS OF 1-METHYL-6-PHENYLIMIDAZO(4,5-B)PYRIDINE MORINAGA MILK IND CO LTD 1999-03-16 JP disclosed