SCHEMBL23328405

SCHEMBL23328405

O=S(=O)(O)CCCCNC(=S)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.67
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
LMNA P02545 5/20 0.67
HTT P42858 3/20 0.67
CDK1 P06493 1/20 0.63
GAA P10253 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
EPHX2 P34913 2/20 0.44
ALOX12 P18054 1/20 0.43
CA12 O43570 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CXCR4 P61073 1/20 0.43
HPGD P15428 1/20 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
SCHEMBL23328393 0.99 SMN1; SMN2 (0.68) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL23328400 0.92 CDK1 (0.67) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL23328872 0.86 SMN1; SMN2 (0.63) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL23328398 0.85 MEN1 (0.63) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL23328369 0.85 MEN1 (0.63) MEN1KMT2AMAPTCA1CA2
SCHEMBL23328363 0.84 CDK1 (0.63) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL23328667 0.83 SMN1; SMN2 (0.66) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL31276967 0.81 CDK1 (0.82) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL17982703 0.81 KMT2A (0.89) SMN1; SMN2MEN1KMT2ALMNAHTT
SCHEMBL17956744 0.81 KMT2A (0.89) SMN1; SMN2MEN1KMT2ALMNAHTT

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 SMN1; SMN2 3087/4885MEN1 1300/4885KMT2A 2533/4885
US-20210128501-A1 ANTIBACTERIAL COMPOUNDS ARF1, ARL1, TLR1 SMN1; SMN2 3087/4885MEN1 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.