SCHEMBL29929982

SCHEMBL29929982

O=C(OC/C=C/c1ccc(O)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.53
▸ CYP3A4 P08684 2/20 0.53
▸ HSPD1 P10809 2/20 0.53
▸ HSPE1 P61604 2/20 0.53
▸ PKM P14618 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ MIF P14174 1/20 0.51
▸ MMP1 P03956 1/20 0.51
▸ MMP2 P08253 1/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ MMP12 P39900 1/20 0.51
▸ AKR1B10 O60218 2/20 0.50
▸ AKR1B1 P15121 2/20 0.50
▸ CA12 O43570 2/20 0.50
▸ CA7 P43166 2/20 0.50
▸ CA9 Q16790 2/20 0.50

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
SCHEMBL8385274 1.00 KMT2A (0.53) KMT2ACYP3A4HSPD1HSPE1PKM
SCHEMBL10598155 0.94 LMNA (0.57) KMT2ACYP3A4HSPD1HSPE1PKM
SCHEMBL10598152 0.94 LMNA (0.57) KMT2ACYP3A4HSPD1HSPE1PKM
SCHEMBL31678923 0.92 ESR1 (0.53) KMT2ARAB9ALMNAMMP1MMP2
SCHEMBL29848511 0.92 ESR1 (0.53) KMT2ARAB9ALMNAMMP1MMP2
SCHEMBL382618 0.90 MMP1 (0.60) KMT2ALMNAMMP1MMP2MMP9
SCHEMBL382617 0.90 MMP1 (0.60) KMT2ALMNAMMP1MMP2MMP9
Benzoic Acid SCHEMBL9957041 0.86 MMP1 (0.56) KMT2AMMP1MMP2MMP9MMP12
SCHEMBL6290523 0.83 SNCA (0.61) KMT2ACYP3A4RAB9ALMNAMMP1
SCHEMBL29177515 0.83 MMP1 (0.53) KMT2AMMP1MMP2MMP9MMP12

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-118871121-A Antimicrobial natural compositions 生物活性协同有限公司 2024-10-29 — — CN claimed
CN-115088734-A Composition of saponin and plant extract Y&B妈妈之选有限公司 2022-09-23 — — CN claimed
CN-118871121-A Antimicrobial natural compositions 生物活性协同有限公司 2024-10-29 — — CN disclosed
CN-118660702-A Antimicrobial compositions 生物活性协同有限公司 2024-09-17 — — CN disclosed
US-11981904-B2 BAHD acyltransferases WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2024-05-14 — — US disclosed
CN-115088734-A Composition of saponin and plant extract Y&B妈妈之选有限公司 2022-09-23 — — 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-11981904-B2 BAHD acyltransferases NAT10, ACOT7, ACAT2 KMT2A 147/4885CYP3A4 4412/4885HSPD1 1485/4885

“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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