SCHEMBL23328875

SCHEMBL23328875

COP(=O)(O)CCCNC(=S)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.63
MEN1 O00255 3/20 0.63
LMNA P02545 3/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
HTT P42858 1/20 0.63
CDK1 P06493 1/20 0.56
ALDH1A1 P00352 3/20 0.48
GAA P10253 3/20 0.47
MAPT P10636 1/20 0.47
EPHX2 P34913 2/20 0.46
TRPV1 Q8NER1 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
SCHEMBL23328371 0.93 CDK1 (0.59) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL23328722 0.88 MEN1 (0.61) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL23328449 0.86 MEN1 (0.67) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL23328720 0.85 CDK1 (0.55) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL23328673 0.81 MEN1 (0.63) KMT2AMEN1EPHX2TRPV1
SCHEMBL23328372 0.81 CDK1 (0.67) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL23328667 0.78 SMN1; SMN2 (0.66) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL27922870 0.77 MEN1 (0.68) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL4396949 0.77 KMT2A (0.64) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL27922871 0.77 CDK1 (0.68) KMT2AMEN1LMNASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20210128501-A1 ANTIBACTERIAL COMPOUNDS ARF1, ARL1, TLR1 KMT2A 2533/4885MEN1 1300/4885LMNA 4486/4885

“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.