SCHEMBL23067398

SCHEMBL23067398

Cc1c(CC(=O)NN)ccc(O)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AOC2 O75106 1/20 0.41
▸ ESR2 Q92731 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ NPY1R P25929 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ HK2 P52789 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ ALPI P09923 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL23067414 0.83 GAA (0.46) KDM4EALDH1A1CYP3A4CYP2C9POLB
SCHEMBL5678308 0.73 GABRA1 (0.46) ESR2ESR1
SCHEMBL23067279 0.73 ALDH1A1 (0.52) KDM4EALDH1A1CYP3A4MEN1LMNA
SCHEMBL29557387 0.73 ALDH1A1 (0.52) KDM4EALDH1A1CYP3A4MEN1LMNA
SCHEMBL28475321 0.72 SELL (0.45) —
SCHEMBL31174385 0.71 ESR2 (0.47) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL960307 0.71 ESR2 (0.47) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL23067180 0.71 FNTA (0.39) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL5384282 0.71 FNTA (0.39) ESR2KDM4EALDH1A1ESR1ADORA3
SCHEMBL23919938 0.71 AMY1A (0.47) ESR2KDM4EESR1CYP3A4CYP2C9

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
CN-114423766-B Pentane derivatives for the treatment of bacterial infections 丹诺医药(苏州)有限公司 2024-05-17 — — CN disclosed
EP-4028404-A2 PENAM DERIVATIVES FOR TREATING BACTERIAL INFECTIONS Tennor Therapeutics Limited (CN) 2022-07-20 — — EP disclosed
CN-114423766-A Penicilliane derivatives for the treatment of bacterial infections 丹诺医药(苏州)有限公司 2022-04-29 — — CN disclosed
US-11040987-B2 Penam derivatives for treating bacterial infections TENNOR THERAPEUTICS LIMITED (CN) 2021-06-22 — — US disclosed
WO-2021048613-A2 PENAM DERIVATIVES FOR TREATING BACTERIAL INFECTIONS TENNOR THERAPEUTICS LIMITED (CN) 2021-03-18 — — WO disclosed
US-20210070774-A1 PENAM DERIVATIVES FOR TREATING BACTERIAL INFECTIONS TENNOR THERAPEUTICS LIMITED (CN) 2021-03-11 — — 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-20210070774-A1 PENAM DERIVATIVES FOR TREATING BACTERIAL INFECTIONS BPGM, BLVRB, PREP AOC2 2073/4885ESR2 1899/4885KDM4E 2135/4885
US-11040987-B2 Penam derivatives for treating bacterial infections BPGM, BLVRB, PREP AOC2 2073/4885ESR2 1899/4885KDM4E 2135/4885

“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.

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