SCHEMBL7008426

SCHEMBL7008426

CC(C)Cc1nn(C)c(C(N)=O)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
TERT O14746 5/20 0.33
IKBKB O14920 2/20 0.33
DAPK3 O43293 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
PRKACA P17612 1/20 0.33
LTK P29376 1/20 0.33
KDR P35968 1/20 0.33
MAP2K2 P36507 1/20 0.33
MAPK8 P45983 1/20 0.33
CSNK1A1 P48729 1/20 0.33
CDK8 P49336 1/20 0.33
CLK2 P49760 1/20 0.33
CDK9 P50750 1/20 0.33
CDK5 Q00535 1/20 0.33
MAP2K1 Q02750 1/20 0.33
PRKCQ Q04759 1/20 0.33
ACVR1 Q04771 1/20 0.33
ROCK1 Q13464 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
SCHEMBL6446624 0.81 SMN1; SMN2 (0.49) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL617 0.78 SMN1; SMN2 (0.61) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
Hydrochloric Acid SCHEMBL7813040 0.77 SMN1; SMN2 (0.60) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL8055642 0.75 SMN1; SMN2 (0.48) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL6717347 0.74 SMN1; SMN2 (0.43) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL17604333 0.74 SMN1; SMN2 (0.36) SMN1; SMN2DAPK3PRKD3MAP4K4PRKACA
SCHEMBL13742735 0.73 SMN1; SMN2 (0.46) SMN1; SMN2TERTDAPK3PRKD3MAP4K4
SCHEMBL1862481 0.73 GAA (0.37) KDM4EUSP2HPGDHSD17B10NMT1
SCHEMBL1095 0.71 PIM3 (0.49) SMN1; SMN2DAPK3PRKD3MAP4K4PRKACA
Hydrochloric Acid SCHEMBL10919018 0.69 PIM3 (0.47) SMN1; SMN2DAPK3PRKD3MAP4K4PRKACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117890459-A Quick screening method for illegally adding chemical drugs into foods based on MSRIT-MS/MS 南京市食品药品监督检验院 2024-04-16 CN claimed
CN-117890459-B Quick screening method for illegally adding chemical drugs into foods based on MSRIT-MS/MS 南京市食品药品监督检验院 2024-10-18 CN disclosed
CN-1136219-C Pyrazolopyrimidinone derivatives for the treatment of impotence ������ҩ��ʽ���� 2004-01-28 CN disclosed
EP-1129093-B1 PYRAZOLOPYRIMIDINONE DERIVATIVES FOR THE TREATMENT OF IMPOTENCE DONG A PHARM CO LTD (KR) 2003-07-23 EP disclosed
US-6583147-B1 5-(2-ethoxy-5-(isopropylamidosulfonyl)phenyl)-1-methyl-3-propy l- 1,6-dihydro-7H-pyrazolo(4,3-d)pyrimidin-7-one; DONG A PHARM CO., LTD. (KR) 2003-06-24 US disclosed
CN-1325398-A Pyrazolopyrimidinone derivatives for the treatment of impotence DONG A PHARM CO LTD (KR) 2001-12-05 CN disclosed
EP-1129093-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES FOR THE TREATMENT OF IMPOTENCE Dong A Pharmaceutical Co. Ltd. (KR) 2001-09-05 EP disclosed
WO-2000027848-A1 PYRAZOLOPYRIMIDINONE DERIVATIVES FOR THE TREATMENT OF IMPOTENCE DONG A PHARM. CO., LTD. (KR) 2000-05-18 WO disclosed