SCHEMBL6200427

SCHEMBL6200427

CCCc1c(N)c(C(N)=O)nn1Cc1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
PDE5A O76074 1/20 0.41
PDE6C P51160 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.40
ADRA1D P25100 1/20 0.38
SIRT1 Q96EB6 1/20 0.37
PARP10 Q53GL7 1/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 3/20 0.37
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
SLC16A3 O15427 3/20 0.36
AURKA O14965 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
SLC16A1 P53985 2/20 0.35

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
SCHEMBL5827229 0.90 ADRA1D (0.40) USP2ALDH1A1MEN1KMT2AMAPK1
SCHEMBL6443240 0.85 ALDH1A1 (0.32) USP2ALDH1A1KDM4E
SCHEMBL6441740 0.85 CTDSP1 (0.36) USP2PDE5APDE6CALDH1A1MEN1
SCHEMBL6446531 0.83 SMN1; SMN2 (0.40) USP2PDE5APDE6CALDH1A1MEN1
Potassium Ion SCHEMBL7393155 0.83 ALDH1A1 (0.31) ALDH1A1MEN1KMT2AMAPK1KDM4E
SCHEMBL6995580 0.81 ADRA1D (0.42) ALDH1A1MEN1KMT2AADRA1DSIRT1
SCHEMBL6447516 0.79 USP2 (0.50) USP2PDE5APDE6CALDH1A1MEN1
Hydrochloric Acid SCHEMBL7394668 0.78 SMN1; SMN2 (0.36) USP2PDE5APDE6CALDH1A1MEN1
SCHEMBL6446771 0.76 PDE5A (0.36) PDE5AMEN1KMT2A
SCHEMBL6200741 0.76 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AMAPK1ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1371647-B1 Pyridine-3-carboxylic acid derivatives and their use as intermediates PFIZER (US) 2005-07-13 EP disclosed
EP-1372656-B1 PYRAZOLO[4,3-D]PYRIMIDINONE COMPOUNDS AS CGMP PDE INHIBITORS PFIZER LTD (GB) 2005-06-22 EP disclosed
US-6784185-B2 PYRAZOLO(4,3-D) PYRIMIDINONE COMPOUNDS USEFUL AS CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASES (CGMP PDES) INHIBITOR PFIZER INC. 2004-08-31 US disclosed
US-6670366-B1 Cyclic guanosine 3',5'-monophosphate phosphodiesterase inhibitors; impotence; pyrazolo(4,3-d)pyrimidin-7-ones PFIZER INC 2003-12-30 US disclosed
EP-1371647-A2 Pyridine-3-carboxylic acid derivatives and their use as intermediates PFIZER INC. (US) 2003-12-17 EP disclosed
EP-1073658-B1 PYRAZOLOPYRIMIDINONE CGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER (US) 2003-08-13 EP disclosed
US-20020198223-A1 Pharmaceutically active compounds PFIZER INC. 2002-12-26 US disclosed
US-6458951-B2 FOR TREATMENT OF MALE ERECTILE DYSFUNCTION, FEMALE SEXUAL DYSFUNCTION PFIZER INC 2002-10-01 US disclosed
US-20010039271-A1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction BUNNAGE MARK EDWARD (GB) 2001-11-08 US disclosed
US-6251904-B1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. 2001-06-26 US disclosed
EP-1073658-A1 PYRAZOLOPYRIMIDINONE CGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER INC. (US) 2001-02-07 EP disclosed
EP-0995750-A1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. (US) 2000-04-26 EP disclosed
WO-1999054333-A1 PYRAZOLOPYRIMIDINONE CGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER INC. (US) 1999-10-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010039271-A1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PDE5A, PDE3A, PDE3B USP2 3533/4885PDE5A 1/4885PDE6C 21/4885
US-20020198223-A1 Pharmaceutically active compounds PDE5A, PDE3A, PDE2A USP2 3818/4885PDE5A 1/4885PDE6C 22/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.