SCHEMBL25877853

SCHEMBL25877853

O=C(CCOCc1ccccc1)Nc1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.73
KMT2A Q03164 9/20 0.73
LMNA P02545 7/20 0.73
ALDH1A1 P00352 7/20 0.73
MAPT P10636 6/20 0.58
HTT P42858 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
RECQL P46063 1/20 0.55
POLB P06746 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
TP53 P04637 1/20 0.51
KDM4E B2RXH2 1/20 0.48
CTSV O60911 1/20 0.47
CTSL P07711 1/20 0.47

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
SCHEMBL29463677 0.81 LMNA (0.65) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL18812865 0.81 LMNA (0.65) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL7650201 0.80 ALDH1A1 (0.57) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL25877852 0.78 ALDH1A1 (0.46) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL7276183 0.78 RAB9A (0.55) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL7823860 0.77 MEN1 (0.70) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL5182303 0.77 LMNA (0.69) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL9843646 0.75 LMNA (0.66) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL6769086 0.74 LMNA (0.64) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL6593159 0.74 LMNA (0.68) MEN1KMT2ALMNAALDH1A1MAPT

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-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2023-07-27 US disclosed
US-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2023-07-27 US disclosed
WO-2021263079-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. (US) 2021-12-30 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-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF FEN1, ERCC4, DCLRE1B MEN1 2245/4885KMT2A 3032/4885LMNA 387/4885

“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.