SCHEMBL4247299

SCHEMBL4247299

Cc1nn2c(=O)n(Cc3ccccc3)c(C)cc2c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
HPGD P15428 3/20 0.50
KMT2A Q03164 2/20 0.49
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
C5AR1 P21730 1/20 0.46
KDM4E B2RXH2 1/20 0.45
KDM4A O75164 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
BRD4 O60885 1/20 0.43
NOTUM Q6P988 1/20 0.43
MAPT P10636 2/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 1/20 0.42
MEN1 O00255 1/20 0.42
BRAF P15056 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
SCHEMBL4385913 0.85 ALDH1A1 (0.49) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4245588 0.85 ALDH1A1 (0.49) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4248842 0.85 ALDH1A1 (0.46) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4247898 0.82 HPGD (0.44) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4248252 0.82 HPGD (0.44) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4247900 0.82 HPGD (0.44) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4248253 0.82 HPGD (0.44) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4249149 0.81 ALDH1A1 (0.43) ALDH1A1HPGDKMT2AC5AR1KDM4E
SCHEMBL4244481 0.79 HPGD (0.41) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2
SCHEMBL4251309 0.79 HPGD (0.41) ALDH1A1HPGDKMT2AMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035426-A1 PYRAZOLOPYRIMIDONES 4SC AG (DE) 2009-03-18 EP disclosed
WO-2007144384-A1 PYRAZOLOPYRIMIDONES 4SC AG (DE) 2007-12-21 WO disclosed