SCHEMBL5878360

SCHEMBL5878360

CCNCC(O)CNC=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.61
ADH1B P00325 4/20 0.46
ADH1A P07327 4/20 0.46
ADH1C P00326 3/20 0.46
ADH7 P40394 3/20 0.37
EPHX1 P07099 1/20 0.33
ADH4 P08319 1/20 0.33
SLC6A2 P23975 1/20 0.31
LMNA P02545 1/20 0.31
HIF1A Q16665 1/20 0.31
GALR3 O60755 1/20 0.31
TP53 P04637 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
SCHEMBL23766640 0.85 ADH1B (0.52) KDM4EADH1BADH1AADH1CADH7
SCHEMBL15510196 0.83 KDM4E (0.67) KDM4ESLC6A2LMNAHIF1AGALR3
SCHEMBL1002824 0.81
SCHEMBL13875203 0.74 ADH1B (0.43) KDM4EADH1BADH1AADH1CADH7
SCHEMBL123088 0.73
SCHEMBL14360756 0.73
SCHEMBL3859640 0.73
SCHEMBL6642864 0.73
SCHEMBL16384409 0.73
SCHEMBL5878845 0.72 ADH1B (0.41) KDM4EADH1BADH1AADH1CADH7

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-7053114-B2 Prodrugs of a 3-(pyrrol-2-ylmethylidene)-2-indolinone derivatives SUGEN, INC. (US) 2006-05-30 US claimed
US-7053114-B2 Prodrugs of a 3-(pyrrol-2-ylmethylidene)-2-indolinone derivatives SUGEN, INC. (US) 2006-05-30 US disclosed
US-6797725-B2 SUCH AS 4-METHYL-5-(2-OXO-1,2-DIHYDROINDOL-3-YLILDENEMETHYL)-1H-PYRROLE-2-CARBOXYLIC ACID FOR PREVENTION AND TREATMENT OF PROTEIN KINASE RELATED CELLULAR DISORDERS; ANTICANCER AGENTS SUGEN, INC. 2004-09-28 US disclosed
US-20040186161-A1 Prodrugs of a 3-(pyrrol-2-ylmethylidene)-2-indolinone derivatives SUGEN, INC. 2004-09-23 US disclosed
US-20030100555-A1 Prodrugs of a 3-(pyrrol-2-ylmethylidene)-2-indolinone derivatives SUGEN. INC. 2003-05-29 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-20040186161-A1 Prodrugs of a 3-(pyrrol-2-ylmethylidene)-2-indolinone derivatives PLK2, CDK2, PDPK1 KDM4E 1069/4885ADH1B 2513/4885ADH1A 1557/4885
US-20030100555-A1 Prodrugs of a 3-(pyrrol-2-ylmethylidene)-2-indolinone derivatives PLK2, CDK2, PDPK1 KDM4E 1069/4885ADH1B 2513/4885ADH1A 1557/4885

“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.