SCHEMBL25877652

SCHEMBL25877652

CC1(Nc2ccc(NC(=O)C3CC3)cc2[N+](=O)[O-])COC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.52
HTT P42858 2/20 0.46
KMT2A Q03164 8/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 4/20 0.44
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 1/20 0.41
MEN1 O00255 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39

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
SCHEMBL24140607 0.81 BACE1 (0.46) NAMPTHTTKMT2ARAB9ANPC1
SCHEMBL25877751 0.81 MAPT (0.47) HTTKMT2AMAPTALDH1A1MEN1
SCHEMBL25877680 0.80 SIRT2 (0.46) HTTKMT2ARAB9ANPC1MAPT
SCHEMBL25877646 0.78 KDR (0.53) KMT2ARAB9ANPC1MAPTALDH1A1
SCHEMBL1504563 0.76 RAB9A (0.72) NAMPTKMT2ARAB9ANPC1MAPT
SCHEMBL25877550 0.76 L3MBTL1 (0.48) KMT2ARAB9ANPC1MAPTALDH1A1
SCHEMBL25877683 0.76 HTT (0.53) HTTKMT2ARAB9AMAPTALDH1A1
SCHEMBL25877653 0.74 LMNA (0.60) NAMPTHTTKMT2ARAB9ANPC1
SCHEMBL25877536 0.74 KDM4E (0.44) KMT2ARAB9AMAPTALDH1A1POLB
SCHEMBL25877852 0.73 ALDH1A1 (0.46) HTTKMT2ARAB9ANPC1MAPT

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 NAMPT 336/4885HTT 1669/4885KMT2A 3032/4885

“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.