SCHEMBL25877852

SCHEMBL25877852

CC1(Nc2ccc(NC(=O)CCOCc3ccccc3)cc2[N+](=O)[O-])COC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
LMNA P02545 1/20 0.46
BCL2L2 Q92843 1/20 0.44
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
MAPT P10636 2/20 0.42
PKM P14618 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CTSV O60911 3/20 0.39
CTSL P07711 3/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP19A1 P11511 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL24140596 0.85 HDAC1 (0.39) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL25877751 0.82 MAPT (0.47) ALDH1A1KMT2AMEN1LMNABCL2L2
SCHEMBL25877853 0.78 MEN1 (0.73) ALDH1A1KMT2AMEN1LMNAMAPT
SCHEMBL25877550 0.75 L3MBTL1 (0.48) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL25877680 0.74 SIRT2 (0.46) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL25877646 0.73 KDR (0.53) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL25877652 0.73 NAMPT (0.52) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL7276183 0.72 RAB9A (0.55) ALDH1A1KMT2AMEN1RAB9ANPC1
SCHEMBL25877683 0.68 HTT (0.53) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL25877386 0.68 MAPK1 (0.47) ALDH1A1KMT2AMEN1LMNARAB9A

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 ALDH1A1 1451/4885KMT2A 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.