SCHEMBL6443280

SCHEMBL6443280

CCc1nn(Cc2nccn2C)c(C(N)=O)c1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 2/20 0.35
NR3C1 P04150 2/20 0.32
FDPS P14324 1/20 0.32
PDE5A O76074 2/20 0.31
HTT P42858 2/20 0.31
ARG1 P05089 1/20 0.30
ARG2 P78540 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
SCHEMBL6443705 0.91 SMN1; SMN2 (0.59) SMN1; SMN2LMNAKMT2AALDH1A1MAPT
SCHEMBL6447590 0.82 FDPS (0.35) KMT2AMEN1NR3C1FDPSPDE5A
SCHEMBL6447551 0.80 LMNA (0.38) SMN1; SMN2LMNAKMT2AALDH1A1MAPT
SCHEMBL28038421 0.78 SMN1; SMN2 (0.60) SMN1; SMN2LMNAKMT2AALDH1A1MAPT
SCHEMBL6202269 0.78 SMN1; SMN2 (0.44) SMN1; SMN2KMT2AALDH1A1
SCHEMBL6443430 0.76 SMN1; SMN2 (0.42) SMN1; SMN2LMNAKMT2AALDH1A1MAPT
SCHEMBL6446715 0.76 SMN1; SMN2 (0.38) SMN1; SMN2NR3C1FDPSPDE5AARG1
SCHEMBL28038719 0.75 SMN1; SMN2 (0.56) SMN1; SMN2KMT2AALDH1A1MAPTMEN1
SCHEMBL6444199 0.75 SMN1; SMN2 (0.43) SMN1; SMN2KMT2AALDH1A1MAPTMEN1
SCHEMBL3579717 0.74 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1229349-C Pyridine-3-carboxylic acid derivative PFIZER (US) 2005-11-30 CN disclosed
EP-1371647-B1 Pyridine-3-carboxylic acid derivatives and their use as intermediates PFIZER (US) 2005-07-13 EP disclosed
CN-1495169-A Pyridine-3-carboxylic acid derivative 2004-05-12 CN disclosed
CN-1134442-C Pyrazolopyrimidinone cGMP PDE5 inhibitor, preparation method and application thereof and intermediate �������۸��¼��������������ι�˾ 2004-01-14 CN 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-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
CN-1305478-A Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER (US) 2001-07-25 CN 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
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 (1 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 SMN1; SMN2 1854/4885LMNA 3708/4885KMT2A 4533/4885

“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.