SCHEMBL5827170

SCHEMBL5827170

CCOc1ncc(S(=O)(=O)N2CCN(CC)CC2)cc1C=O

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.67
ALDH1A1 P00352 2/20 0.54
CYP2D6 P10635 1/20 0.51
PDE5A O76074 9/20 0.48
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL2402633 0.83 ALDH1A1 (0.70) KMT2AALDH1A1CYP2D6PDE5AKDM4E
SCHEMBL6441707 0.80 KMT2A (1.00) KMT2AALDH1A1CYP2D6PDE5AKDM4E
SCHEMBL3587341 0.80 KMT2A (1.00) KMT2AALDH1A1CYP2D6PDE5AKDM4E
Hydrochloric Acid SCHEMBL6386723 0.79 KMT2A (0.98) KMT2AALDH1A1CYP2D6PDE5AKDM4E
Hydrochloric Acid SCHEMBL6442412 0.79 KMT2A (0.98) KMT2AALDH1A1CYP2D6PDE5AKDM4E
SCHEMBL6441696 0.79 KMT2A (0.98) KMT2AALDH1A1CYP2D6PDE5AKDM4E
SCHEMBL3576451 0.78 KMT2A (0.80) KMT2AALDH1A1CYP2D6PDE5AGAA
Hydrochloric Acid SCHEMBL6386719 0.78 KMT2A (0.80) KMT2AALDH1A1CYP2D6PDE5AKDM4E
SCHEMBL6441699 0.78 KMT2A (0.80) KMT2AALDH1A1CYP2D6PDE5AKDM4E
SCHEMBL6444959 0.78 KMT2A (0.72) KMT2AALDH1A1CYP2D6PDE5AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067660-B2 such as 1-(4-ethoxy-3-formylphenylsulfonyl)-4-methylpiperazine; for use as anti-impotence agent PFIZER INC. (US) 2006-06-27 US disclosed
EP-1296983-B1 NOVEL PROCESS FOR THE PREPARATION OF PYRAZOLOPYRIMIDINONES PFIZER LTD (GB) 2004-11-17 EP disclosed
US-20040110948-A1 Novel process for the preparation of pyrazolopyrimidinones PFIZER INC 2004-06-10 US disclosed
US-6730786-B2 REACTING A BENZAMIDINE COMPOUND WITH A AMIDE SUBSTITUTED PYRAZOLE COMPOUND PFIZER INC 2004-05-04 US disclosed
EP-1296983-A1 NOVEL PROCESS FOR THE PREPARATION OF PYRAZOLOPYRIMIDINONES Pfizer Limited (GB) 2003-04-02 EP disclosed
US-20020013465-A1 Novel process for the preparation of pyrazolopyrimidinones PFIZER INC. 2002-01-31 US disclosed
WO-2001098303-A1 NOVEL PROCESS FOR THE PREPARATION OF PYRAZOLOPYRIMIDINONES PFIZER LIMITED (GB) 2001-12-27 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-20020013465-A1 Novel process for the preparation of pyrazolopyrimidinones SDHA, NDUFS3, NDUFS2 KMT2A 3944/4885ALDH1A1 163/4885CYP2D6 30/4885
US-20040110948-A1 Novel process for the preparation of pyrazolopyrimidinones SDHA, NDUFS3, NDUFS2 KMT2A 3944/4885ALDH1A1 163/4885CYP2D6 30/4885

“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.