SCHEMBL5229288

SCHEMBL5229288

CSc1ccc(-c2nnc(Cl)cc2-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
ATM Q13315 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CSNK1D P48730 2/20 0.41
MAPK11 Q15759 2/20 0.41
MAPK14 Q16539 2/20 0.41
PTGS2 P35354 5/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGS1 P23219 3/20 0.39
SOAT1 P35610 3/20 0.39

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
SCHEMBL5223261 0.89 GSK3B (0.42) NPSR1ALDH1A1LMNAATMSMN1; SMN2
SCHEMBL5222256 0.87 PTGS1 (0.46) NPSR1ALDH1A1CSNK1DMAPK11MAPK14
SCHEMBL1752937 0.85 CSNK1D (0.47) NPSR1ALDH1A1LMNAATMSMN1; SMN2
SCHEMBL1013453 0.79 AKT1 (0.42) ALDH1A1CSNK1DMAPK11MAPK14KMT2A
SCHEMBL5221958 0.79 ALDH1A1 (0.51) NPSR1ALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL1597390 0.78 MAPK14 (0.60) SMN1; SMN2CSNK1DMAPK11MAPK14
SCHEMBL5225080 0.77 NPSR1 (0.50) NPSR1ALDH1A1LMNAATMSMN1; SMN2
SCHEMBL5224594 0.76 ADORA2A (0.41) NPSR1ALDH1A1LMNAATMSMN1; SMN2
SCHEMBL1041929 0.76 KIF11 (0.50) CSNK1DMAPK11MAPK14MEN1KMT2A
SCHEMBL30042717 0.76 KIF11 (0.50) CSNK1DMAPK11MAPK14MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300399-B1 PHENYLPYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2007-08-22 EP disclosed
US-6664256-B1 Interleukin- 1 beta inhibitors KOWA CO., LTD. (JP) 2003-12-16 US disclosed
EP-1300399-A1 PHENYLPYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME Kowa Co., Ltd. (JP) 2003-04-09 EP disclosed