SCHEMBL5263281

SCHEMBL5263281

CCCn1c(=O)oc(=O)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.50
KDM4E B2RXH2 2/20 0.49
GAA P10253 2/20 0.49
RORA P35398 1/20 0.47
RORC P51449 1/20 0.47
RORB Q92753 1/20 0.47
ALDH1A1 P00352 7/20 0.47
NPSR1 Q6W5P4 1/20 0.46
HPGD P15428 4/20 0.46
LMNA P02545 3/20 0.46
POLB P06746 3/20 0.46
HSD17B10 Q99714 2/20 0.46
TSHR P16473 4/20 0.45
MAPK1 P28482 3/20 0.45
USP2 O75604 3/20 0.45
ALOX15 P16050 2/20 0.45
MAPT P10636 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
TDP1 Q9NUW8 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
SCHEMBL1061987 0.90 PGR (0.60) PGRKDM4EGAARORARORC
SCHEMBL2453991 0.89 PGR (0.55) PGRKDM4ERORARORCRORB
SCHEMBL6305077 0.86 ALDH1A1 (0.59) PGRKDM4ERORARORCRORB
SCHEMBL6232603 0.83 ALDH1A1 (0.43) PGRRORARORCRORBALDH1A1
SCHEMBL6233906 0.83 ALDH1A1 (0.43) PGRRORARORCRORBALDH1A1
SCHEMBL17208787 0.83 TOP2A (0.52) ALDH1A1NPSR1HPGDLMNAPOLB
SCHEMBL5308775 0.83 ALDH1A1 (0.55) KDM4EALDH1A1NPSR1HPGDLMNA
SCHEMBL6685738 0.82 ALDH1A1 (0.41) PGRKDM4ERORARORCRORB
SCHEMBL6236721 0.82 ALDH1A1 (0.67) ALDH1A1NPSR1LMNATSHRMAPK1
SCHEMBL18474288 0.82 SLC6A4 (0.49) PGRKDM4ERORARORCRORB

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
CN-122036604-A Compound and application thereof 中国药科大学 2026-05-15 CN disclosed
CN-110325540-A Post-transcriptional chemically modified double-stranded RNA 纳诺索尔公司 2019-10-11 CN disclosed
CN-109943222-A A kind of cross-linking type nano hybridization cyanic acid ester paint 浙江中科应化科技有限公司 2019-06-28 CN disclosed
US-20070238763-A1 Urea derivatives as integrin a4 antagonists LABORATORIOS ALMIRALL, S.A. 2007-10-11 US disclosed
EP-1383750-B1 UREA DERIVATIVES AS INTEGRIN ALPHA 4 ANTAGONISTS ALMIRALL LAB (ES) 2007-09-26 EP disclosed
US-7253171-B2 Urea derivatives as integrin α4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2007-08-07 US disclosed
US-20040142982-A1 Urea derivatives as integrin alpha 4 antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2004-07-22 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-20040142982-A1 Urea derivatives as integrin alpha 4 antagonists ITGA4, ITGB4, ITGA1 PGR 1895/4885KDM4E 1230/4885GAA 3296/4885
US-20070238763-A1 Urea derivatives as integrin a4 antagonists ITGB4, ITGA4, ITGB7 PGR 3910/4885KDM4E 615/4885GAA 3427/4885

“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.