SCHEMBL25877751

SCHEMBL25877751

CCCC(=O)Nc1ccc(NC2(C)COC2)c([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
HTT P42858 4/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
ALDH1A1 P00352 5/20 0.42
ALOX12 P18054 1/20 0.42
BCL2L2 Q92843 1/20 0.42
KDM4E B2RXH2 2/20 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
SCHEMBL25877852 0.82 ALDH1A1 (0.46) MAPTKMT2AMEN1HTTLMNA
SCHEMBL24141142 0.81 ALDH1A1 (0.45) MAPTKMT2AMEN1LMNAHPGD
SCHEMBL25877652 0.81 NAMPT (0.52) MAPTKMT2AMEN1HTTLMNA
SCHEMBL25877680 0.79 SIRT2 (0.46) MAPTKMT2AMEN1HTTLMNA
SCHEMBL25877646 0.77 KDR (0.53) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL25877550 0.75 L3MBTL1 (0.48) MAPTKMT2AMEN1LMNAHPGD
SCHEMBL25877683 0.75 HTT (0.53) MAPTKMT2AMEN1HTTLMNA
SCHEMBL5182303 0.74 LMNA (0.69) MAPTKMT2AMEN1HTTLMNA
SCHEMBL7003484 0.74 MEN1 (0.62) MAPTKMT2AMEN1HTTLMNA
SCHEMBL3341413 0.73 LMNA (0.53) MAPTKMT2AMEN1HTTLMNA

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 MAPT 3694/4885KMT2A 3032/4885MEN1 2245/4885

“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.