SCHEMBL23328386

SCHEMBL23328386

CC(C)(C)OC(=O)CNC(=S)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
LMNA P02545 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HTT P42858 3/20 0.56
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
EPHX2 P34913 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
ABAT P80404 1/20 0.43
MTOR P42345 2/20 0.43

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
SCHEMBL23328731 0.86 MEN1 (0.61) MEN1KMT2ALMNAHTTMAPT
SCHEMBL25840843 0.85 SMN1; SMN2 (0.51) MEN1KMT2ASMN1; SMN2HTTMAPT
SCHEMBL1258488 0.83 ABAT (0.64) MEN1KMT2ALMNASMN1; SMN2HTT
SCHEMBL4396949 0.82 KMT2A (0.64) CDK1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL1433633 0.81 IDH1 (0.47) MEN1KMT2ALMNAHTTMAPT
SCHEMBL23328373 0.81 ABAT (0.66) CDK1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL10453740 0.80 IDO1 (0.49) MEN1KMT2ALMNAHTTMAPT
SCHEMBL5803117 0.79 PTPRC (0.54) SMN1; SMN2EPHX2TRPV1
SCHEMBL1138925 0.76 EPHX2 (0.59) MEN1KMT2ALMNAHTTMAPT
SCHEMBL14386106 0.76 LMNA (0.72) CDK1MEN1KMT2ALMNASMN1; SMN2

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-11701333-B2 Antibacterial compounds Kent Innovation & Enterprise (GB) 2023-07-18 US disclosed
US-20210128501-A1 ANTIBACTERIAL COMPOUNDS KENT INNOVATION & ENTERPRISE, UNIVERSITY OF KENT (GB) 2021-05-06 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-11701333-B2 Antibacterial compounds ARF1, ARL1, TLR1 CDK1 1597/4885MEN1 1300/4885KMT2A 2533/4885
US-20210128501-A1 ANTIBACTERIAL COMPOUNDS ARF1, ARL1, TLR1 CDK1 1597/4885MEN1 1300/4885KMT2A 2533/4885

“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.