SCHEMBL3235482

SCHEMBL3235482

CCCOc1ccc(S(=O)(=O)NC(=O)CCC2CCCN2C)cc1-c1nc(=O)c2c([nH]1)c(CCC)nn2C

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 19/20 0.65
HDAC1 Q13547 3/20 0.49
HDAC6 Q9UBN7 3/20 0.49
HDAC2 Q92769 2/20 0.49
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
KDM4E B2RXH2 1/20 0.46
HDAC3 O15379 1/20 0.45
NCOR2 Q9Y618 1/20 0.45

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
Udenafil SCHEMBL69463 0.89 PDE5A (0.80) PDE5A
Udenafil SCHEMBL438563 0.89 PDE5A (0.80) PDE5A
SCHEMBL325269 0.88 PDE5A (0.74) PDE5A
SCHEMBL3236691 0.86 PDE5A (0.56) PDE5AHDAC1HDAC6HDAC2PDE3B
SCHEMBL18269491 0.86 PDE5A (0.62) PDE5AHDAC1HDAC6HDAC2PDE3B
SCHEMBL6285398 0.83 PDE5A (0.78) PDE5AHDAC1HDAC6HDAC2PDE3B
Udenafil SCHEMBL30452348 0.79 PDE5A (1.00) PDE5AKDM4E
Udenafil SCHEMBL120993 0.79 PDE5A (1.00) PDE5AKDM4E
SCHEMBL23641917 0.78 PDE5A (0.72) PDE5A
SCHEMBL18416780 0.78 PDE5A (0.69) PDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581480-B1 CYCLOPENTYL-SUBSTITUTED GLUTARAMIDE COMPOUNDS AS ENDOPEPTIDASE-V INHIBITORS PFIZER LTD (GB) 2006-08-23 EP claimed
US-20240182519-A1 MELANOCORTIN RECEPTOR LIGANDS MODIFIED WITH HYDANTOIN IPSEN PHARMA S.A.S. (FR) 2024-06-06 US disclosed
US-7745630-B2 Triazolyl piperidine arginine vasopressin receptor modulators BRYANS JUSTIN STEPHEN 2010-06-29 US disclosed
US-20090227562-A1 Combination of a Selective Noradrenaline Reuptake Unhibitor and a PDEV Inhibitor PFIZER INC. (US) 2009-09-10 US disclosed
EP-1778241-A1 COMBINATION OF A SELECTIVE NORADRENALINE REUPTAKE INHIBITOR AND A PDEV INHIBITOR Pfizer Limited (GB) 2007-05-02 EP disclosed
WO-2006016262-A1 COMBINATION OF A SELECTIVE NORADRENALINE REUPTAKE INHIBITOR AND A PDEV INHIBITOR PFIZER LIMITED (GB) 2006-02-16 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-20240182519-A1 MELANOCORTIN RECEPTOR LIGANDS MODIFIED WITH HYDANTOIN MC4R, MC3R, MC1R PDE5A 895/4885HDAC1 961/4885HDAC6 1375/4885
US-20090227562-A1 Combination of a Selective Noradrenaline Reuptake Unhibitor and a PDEV Inhibitor PDE4A, PDE12, PDE4B PDE5A 4/4885HDAC1 1080/4885HDAC6 1453/4885

“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.