SCHEMBL25877471

SCHEMBL25877471

CC1(Nc2cc(-c3ncno3)ccc2[N+](=O)[O-])COC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.35
MAPT P10636 6/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
GAA P10253 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
TP53 P04637 3/20 0.32
RXFP1 Q9HBX9 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL24141251 0.81 BACE1 (0.34)
SCHEMBL25877483 0.77 MAPT (0.43) POLBMAPTLMNAHTTNPC1
SCHEMBL25877590 0.75 MAPT (0.34) POLBMAPTLMNAHTTALDH1A1
SCHEMBL25877480 0.74 MAPT (0.38) POLBMAPTRAB9AALDH1A1MAPK1
SCHEMBL30964077 0.72 MAPT (0.54) POLBMAPTLMNAHTTNPC1
SCHEMBL25877435 0.72 ALDH1A1 (0.42) POLBMAPTLMNAGAAALDH1A1
SCHEMBL25877451 0.71 VCAM1 (0.44) POLBMAPTLMNARAB9AALDH1A1
SCHEMBL25877386 0.70 MAPK1 (0.47) MAPTLMNANPC1RAB9AGAA
SCHEMBL25877473 0.70 LMNA (0.46) POLBMAPTLMNAHTTGAA
SCHEMBL25877891 0.70 ALDH1A1 (0.53) POLBMAPTLMNAHTTGAA

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 1 patent. 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

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 POLB 64/4885MAPT 3694/4885LMNA 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.