SCHEMBL1746367

SCHEMBL1746367

CCNc1ncccc1[N]C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.41
UTS2R Q9UKP6 1/20 0.40
POLB P06746 1/20 0.39
IDO1 P14902 1/20 0.38
HPGD P15428 5/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 3/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP3A4 P08684 1/20 0.36
PGK1 P00558 2/20 0.35
L3MBTL1 Q9Y468 3/20 0.34
GAA P10253 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
FDPS P14324 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL1744463 0.86 ALDH1A1 (0.53) GRM5UTS2RHPGDALDH1A1KDM4E
SCHEMBL12189388 0.84 GRM5 (0.40) GRM5UTS2RPOLBIDO1HPGD
SCHEMBL1744803 0.81 KDM4E (0.41) HPGDALDH1A1KDM4EHSD17B10CYP1A2
SCHEMBL1746872 0.81 KDM4E (0.43) POLBHPGDALDH1A1KDM4EHSD17B10
SCHEMBL1744376 0.79 KDM4E (0.36) GRM5ALDH1A1KDM4EL3MBTL1GAA
SCHEMBL1745114 0.78 UTS2R (0.46) UTS2RPOLBALDH1A1KDM4EHSD17B10
SCHEMBL1746375 0.78 UTS2R (0.46) UTS2RHPGDALDH1A1KDM4EHSD17B10
SCHEMBL1746870 0.78 CYP2C19 (0.51) POLBHSD17B10CYP2C19L3MBTL1GAA
SCHEMBL1746378 0.75 ALDH1A1 (0.51) POLBHPGDALDH1A1KDM4EHSD17B10
SCHEMBL4036232 0.75 FDPS (0.54) GRM5UTS2RALDH1A1KDM4EHSD17B10

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 12 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
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