SCHEMBL10201428

SCHEMBL10201428

O=C1NCCc2cc(I)c(O)cc21

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
PARP10 Q53GL7 13/20 0.47
PARP11 Q9NR21 9/20 0.47
PARP1 P09874 7/20 0.47
F7 P08709 1/20 0.47
F3 P13726 1/20 0.47
PDPK1 O15530 1/20 0.44
ACHE P22303 1/20 0.44
GRM5 P41594 3/20 0.41

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
SCHEMBL10201433 0.90 KDM4E (0.41) KDM4EPARP10PARP11PARP1F7
SCHEMBL24136646 0.85 KDM4E (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL29600821 0.85 KDM4E (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL15830717 0.79 PARP10 (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL31443844 0.79 PARP10 (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL4500561 0.79 PARP10 (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL29977721 0.76 PARP10 (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL20488275 0.76 PARP10 (0.56) KDM4EPARP10PARP11PARP1F7
SCHEMBL31167714 0.76 PARP10 (0.47) KDM4EPARP10PARP11PARP1F7
SCHEMBL15831695 0.76 PARP10 (0.47) KDM4EPARP10PARP11PARP1F7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217966-A1 PHARMACEUTICAL COMPOSITION CONTAINING GLP-1 RECEPTOR AGONIST HAVING FUSED RING SHIONOGI & CO., LTD. (JP) 2024-07-04 US disclosed
US-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 US disclosed
US-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 US 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-20240217966-A1 PHARMACEUTICAL COMPOSITION CONTAINING GLP-1 RECEPTOR AGONIST HAVING FUSED RING GLP1R, GIPR, GCGR KDM4E 3785/4885PARP10 2063/4885PARP11 2655/4885
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, ADAMTS1, ADAMTS7 KDM4E 4592/4885PARP10 2737/4885PARP11 2380/4885

“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.