SCHEMBL22279815

SCHEMBL22279815

COC(=O)[C@H]1CN(Cc2ccc(OC)cc2)C(=O)[C@@H]1c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ MMP1 P03956 1/20 0.47
▸ MMP13 P45452 1/20 0.47
▸ SIRT2 Q8IXJ6 1/20 0.46
▸ SIRT1 Q96EB6 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43
▸ CACNA1G O43497 1/20 0.43
▸ CACNA1H O95180 1/20 0.43
▸ CACNA1I Q9P0X4 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ FAAH O00519 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL20875914 0.91 MEN1 (0.52) MEN1KMT2AMMP1MMP13SIRT2
SCHEMBL22262834 0.84 SIGMAR1 (0.48) MEN1KMT2AMMP1MMP13SIRT2
SCHEMBL20875995 0.81 MEN1 (0.49) MEN1KMT2AMMP1MMP13SIRT2
SCHEMBL22279886 0.81 MEN1 (0.49) MEN1KMT2AMMP1MMP13SIRT2
SCHEMBL20875996 0.81 MEN1 (0.49) MEN1KMT2AMMP1MMP13SIRT2
SCHEMBL22279598 0.80 TRPC5 (0.46) MEN1KMT2AALDH1A1PKM
SCHEMBL20875902 0.79 MEN1 (0.52) MEN1KMT2ASIRT2SIRT1SIGMAR1
SCHEMBL20875900 0.79 MEN1 (0.52) MEN1KMT2ASIRT2SIRT1SIGMAR1
SCHEMBL20875929 0.78 CCKBR (0.51) MEN1KMT2ASIRT1CYP2C19
SCHEMBL22279884 0.76 SIGMAR1 (0.43) MEN1KMT2AMMP1MMP13SIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11180479-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-11-23 — — US disclosed
US-20200239446-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2020-07-30 — — 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-11180479-B2 Antiviral compounds PLA2G1B, PLA2G4A, PLA2G4C MEN1 4027/4885KMT2A 4046/4885MMP1 3362/4885
US-20200239446-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G4A, PLA2G4C MEN1 4027/4885KMT2A 4046/4885MMP1 3362/4885

“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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