SCHEMBL18202255

SCHEMBL18202255

Cc1c2n(c3cc(F)ccc13)CCOC2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 11/20 0.39
PER2 O15055 2/20 0.36
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
CRY2 Q49AN0 1/20 0.35
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HTR7 P34969 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 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
SCHEMBL18202161 0.88 PER2 (0.41) KCNK3PER2CRY2PIK3CAPIK3CB
SCHEMBL19921337 0.82 KCNK3 (0.36) KCNK3PER2MAPK8MAPK9CRY2
SCHEMBL19930207 0.78 HTR2A (0.53) ALDH1A1KDM4EHTR2AHTR2C
SCHEMBL19921257 0.77 LPL (0.34) KCNK3PER2CRY2HTR7
SCHEMBL18540624 0.73 HTR2A (0.58) PIK3CAPIK3CBPIK3CGKDM4EHTR2A
SCHEMBL18202353 0.73 PER2 (0.40) KCNK3PER2CRY2PIK3CAPIK3CB
SCHEMBL19960991 0.73 PER2 (0.44) KCNK3PER2CRY2PIK3CAPIK3CB
SCHEMBL31487332 0.70 PER2 (0.38) KCNK3PER2CRY2ALDH1A1KDM4E
SCHEMBL18202302 0.70 CSNK1D (0.32) KCNK3PER2CRY2PIK3CAPIK3CB
SCHEMBL31487078 0.70 PER2 (0.38) KCNK3PER2CRY2

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
EP-3290419-B1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2019-08-07 EP disclosed
EP-3312179-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-25 EP disclosed
EP-3290419-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-07 EP disclosed
WO-2016173438-A1 FUSED-RING OR TRICYCLIC ARYL PYRIMIDINE COMPOUND USED AS KINASE INHIBITOR 南京明德新药研发股份有限公司 2016-11-03 WO disclosed