SCHEMBL23631652

SCHEMBL23631652

O=C(O)CNC(=O)Cn1ccc2ccc(Cl)cc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.62
▸ KDM4E B2RXH2 5/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ HSD17B10 Q99714 4/20 0.49
▸ HPGD P15428 3/20 0.49
▸ TSHR P16473 3/20 0.49
▸ GLA P06280 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ OXER1 Q8TDS5 1/20 0.48
▸ NPY5R Q15761 1/20 0.47
▸ MCL1 Q07820 1/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ ACLY P53396 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ RHEB Q15382 1/20 0.43
▸ APOBEC3A P31941 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ APOBEC3G Q9HC16 1/20 0.43
▸ KRAS P01116 1/20 0.43
▸ SHMT1 P34896 2/20 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
SCHEMBL29957878 0.85 KMO (0.72) KMOOXER1NPY5RMCL1KMT2A
SCHEMBL1576364 0.85 KMO (0.72) KMOOXER1NPY5RMCL1KMT2A
SCHEMBL23631670 0.85 KDM4E (0.48) KMOKDM4EALDH1A1HSD17B10HPGD
SCHEMBL23631602 0.85 KDM4E (0.48) KMOKDM4EALDH1A1HSD17B10HPGD
SCHEMBL23631570 0.83 KDM4E (0.52) KMOKDM4EALDH1A1HSD17B10HPGD
SCHEMBL23631661 0.82 KDM4E (0.46) KMOKDM4EALDH1A1HSD17B10HPGD
SCHEMBL6138108 0.81 KMT2A (0.69) KDM4EALDH1A1HSD17B10HPGDTSHR
SCHEMBL23631689 0.81 KDM4E (0.45) KMOKDM4EALDH1A1HSD17B10HPGD
SCHEMBL23631657 0.81 KDM4E (0.45) KMOKDM4EALDH1A1HSD17B10HPGD
SCHEMBL23631701 0.81 KRAS (0.46) KMOKDM4EALDH1A1HSD17B10HPGD

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-20210214359-A1 Compounds and Methods for Treating Bacterial Infections UNIV NEW YORK (US) 2021-07-15 — — US claimed
US-20210214359-A1 Compounds and Methods for Treating Bacterial Infections UNIV NEW YORK (US) 2021-07-15 — — 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 (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-20210214359-A1 Compounds and Methods for Treating Bacterial Infections CBS, MPO, QSOX1 KMO 257/4885KDM4E 2239/4885ALDH1A1 744/4885

“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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