SCHEMBL3960641

SCHEMBL3960641

CCCc1n[nH]c(C(=O)NC)c1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.37
PLK1 P53350 2/20 0.37
BRD4 O60885 2/20 0.36
BRPF1 P55201 2/20 0.36
CREBBP Q92793 2/20 0.36
EP300 Q09472 1/20 0.36
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTPN11 Q06124 1/20 0.33
MAPT P10636 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
PDK2 Q15119 1/20 0.31
ALPL P05186 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 2/20 0.31
RAB9A P51151 1/20 0.31
YTHDC1 Q96MU7 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL6633569 0.89 GLA (0.34) GLAALDH1A1SMN1; SMN2MAPT
SCHEMBL3827995 0.87 GLA (0.37) GLAALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL7851736 0.83 PTPN11 (0.31) BRD4BRPF1CREBBPEP300PTPN11
SCHEMBL1349 0.81 GLA (0.40) GLAALDH1A1SMN1; SMN2MAPTHCAR2
SCHEMBL6442196 0.77 CHRM4 (0.39) RAB9A
SCHEMBL4744537 0.76 SMN1; SMN2 (0.41) PLK1BRD4BRPF1CREBBPEP300
SCHEMBL27848537 0.74 BRD4 (0.37) BRD4BRPF1CREBBPEP300ALDH1A1
SCHEMBL6447518 0.73 RAB9A (0.51) ALDH1A1SMN1; SMN2POLBRAB9AKDM4E
SCHEMBL8187632 0.71 TLR8 (0.41) ALDH1A1MAPTTSHRRAB9AKDM4E
SCHEMBL27614783 0.68 SMN1; SMN2 (0.35) GLAALDH1A1SMN1; SMN2MAPTHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001022918-A2 METHOD OF PREPARATION OF SILDENAFIL INST FARMACEUTYCZNY (PL) 2001-04-05 WO claimed
WO-2009124119-A2 PHOSPHODIESTERASE INHIBITORS AND USES THEREOF The Trustes of Columbia University in the City of New York (US) 2009-10-08 WO disclosed
WO-2009071707-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-06-11 WO disclosed
WO-2009071706-A1 PYRAZOLEPYRIMIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-06-11 WO disclosed
EP-2024369-A2 NOVEL PROCESS FOR THE PREPARATION OF SILDENAFIL CITRATE Matrix Laboratories Ltd (IN) 2009-02-18 EP disclosed
WO-2008071650-A2 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-19 WO disclosed
WO-2007141805-A2 NOVEL PROCESS FOR THE PREPARATION OF SILDENAFIL CITRATE MATRIX LABORATORIES LIMITED (IN) 2007-12-13 WO disclosed
EP-1444234-A2 DEUTERATED PYRAZOLOPYRIMIDINONES AND DRUGS CONTAINING SAID COMPOUNDS Turicum Drug Development AG (CH) 2004-08-11 EP disclosed
WO-2003053974-A1 NOVEL COMPOUNDS AND THEIR USE IN MEDICINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2003-07-03 WO disclosed
WO-2003039439-A2 DEUTERATED PYRAZOLOPYRIMIDINONES AND DRUGS CONTAINING SAID COMPOUNDS TURICUM DRUG DEVELOPMENT AG (CH) 2003-05-15 WO disclosed
WO-2002016364-A1 POLYETHOXYLATED PYRAZOLO PYRIMIDINONE DERIVATIVES, PROCESS FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME FOR THE TREATMENT OF IMPOTENCE LG LIFE SCIENCES LTD. (KR) 2002-02-28 WO disclosed
WO-2001003644-A9 PYRAZOLOPYRIMIDINONE DERIVATIVES CONJUGATED TO THIOPHENE MOIETIES OR BENZO [FUSED] 5-MEMBERED HETEROCYCLES FOR ERECTILE DYSFUNCTION PICOWER INST MED RES (US) 2001-11-29 WO disclosed
WO-2001022918-A2 METHOD OF PREPARATION OF SILDENAFIL INST FARMACEUTYCZNY (PL) 2001-04-05 WO disclosed
EP-1085893-A1 PHOSPHODIESTERASE-V MODULATOR DRUGS AND THEIR USES Advanced Medicine, Inc. (US) 2001-03-28 EP disclosed
WO-2001003644-A2 PYRAZOLOPYRIMIDINONE DERIVATIVES CONJUGATED TO THIOPHENE MOIETIES OR BENZO [FUSED] 5-MEMBERED HETEROCYCLES FOR ERECTILE DYSFUNCTION THE PICOWER INSTITUTE FOR MEDICAL RESEARCH (US) 2001-01-18 WO disclosed
WO-1999064033-A9 PHOSPHODIESTERASE-V MODULATOR DRUGS AND THEIR USES ADVANCED MEDICINE INC (US) 2000-07-27 WO disclosed
WO-1999064033-A1 PHOSPHODIESTERASE-V MODULATOR DRUGS AND THEIR USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed