SCHEMBL23217034

SCHEMBL23217034

O=C(NO)C(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.57
LMNA P02545 5/20 0.57
GAA P10253 4/20 0.57
HTT P42858 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
TRPV4 Q9HBA0 1/20 0.56
ALDH1A1 P00352 4/20 0.55
KMT2A Q03164 3/20 0.54
MEN1 O00255 1/20 0.54
KDM4E B2RXH2 1/20 0.54
PAX8 Q06710 1/20 0.53
POLB P06746 1/20 0.52
USP2 O75604 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL30889350 1.00 MAPT (0.57) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL23217016 0.91 HTT (0.60) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL30889354 0.88 ALDH1A1 (0.58) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL23217102 0.88 ALDH1A1 (0.58) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL23217100 0.88 MAPT (0.70) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL1870289 0.85 F13A1 (0.72) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL30006605 0.82 TRPV4 (0.57) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL30005853 0.82 TRPV4 (0.57) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL23217103 0.82 LMNA (0.49) MAPTLMNAGAAHTTSMN1; SMN2
SCHEMBL23217419 0.81 LMNA (0.49) MAPTLMNAGAAHTTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124400-A1 LPXH TARGETING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING THE SAME DUKE UNIVERSITY (US) 2024-04-18 US disclosed
WO-2021072369-A1 LPXH TARGETING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING THE SAME DUKE UNIVERSITY (US) 2021-04-15 WO disclosed
WO-2021072369-A1 LPXH TARGETING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING THE SAME DUKE UNIVERSITY (US) 2021-04-15 WO 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-20240124400-A1 LPXH TARGETING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF MAKING AND USING THE SAME CFH, LPAR3, CBR3 MAPT 4754/4885LMNA 512/4885GAA 4250/4885

“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.