SCHEMBL29990643

SCHEMBL29990643

C=C(N)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 3/20 0.47
F2 P00734 2/20 0.47
PLG P00747 1/20 0.47
PLAU P00749 1/20 0.47
PLAT P00750 1/20 0.47
KLKB1 P03952 1/20 0.47
PRSS2 P07478 2/20 0.43
PRSS3 P35030 2/20 0.43
TMPRSS6 Q8IU80 1/20 0.43
ST14 Q9Y5Y6 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
ALDH1A1 P00352 2/20 0.39
GAA P10253 2/20 0.39
MAPK1 P28482 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NAMPT P43490 1/20 0.38
PEPD P12955 1/20 0.38

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
SCHEMBL17087004 0.86 F2 (0.54) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL2452374 0.81 RXFP1 (0.59) PRSS1F2PLGPLAUPLAT
SCHEMBL23713151 0.80 PEPD (0.59) PRSS1F2PLGPLAUPLAT
SCHEMBL17087017 0.80 PTPN1 (0.53) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL459482 0.76 SMN1; SMN2 (0.54) MEN1KMT2AHDAC1HDAC6ALDH1A1
SCHEMBL6631155 0.76 MEN1 (0.46) PRSS1F2PLGPLAUPLAT
SCHEMBL18843562 0.76 HDAC1 (0.57) MEN1KMT2AHDAC1HDAC6KDM4E
SCHEMBL1276799 0.74 MEN1 (0.47) PRSS1F2PLGPLAUPLAT
SCHEMBL5464327 0.73 F2 (0.41) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL19154569 0.73 CA1 (0.58) PRSS1F2PLGPLAUPLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066133-A1 THERAPEUTIC AGENTS AND CONJUGATES THEREOF AJ SCIENCES (YIXING) CO., LTD (CN) 2024-02-29 US disclosed
EP-4114417-A2 THERAPEUTIC AGENTS AND CONJUGATES THEREOF Beijing Xuanyi Pharmasciences Co., Ltd. (CN) 2023-01-11 EP disclosed
CN-115427051-A Therapeutic agents and conjugates thereof 北京轩义医药科技有限公司 2022-12-02 CN 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 (1 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-20240066133-A1 THERAPEUTIC AGENTS AND CONJUGATES THEREOF TLR9, STING1, TLR3 PRSS1 3918/4885F2 2792/4885PLG 4855/4885

“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.