SCHEMBL25609751

SCHEMBL25609751

O=C(O)c1ccc(-n2nnnc2SCC(=O)C2CCCCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.58
▸ ALDH1A1 P00352 6/20 0.55
▸ TSHR P16473 2/20 0.55
▸ GAA P10253 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.54
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ PPARG P37231 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.52
▸ POLB P06746 2/20 0.52
▸ MAPT P10636 1/20 0.52
▸ HSD11B1 P28845 1/20 0.50

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
SCHEMBL24019582 0.84 ALDH1A1 (0.79) HPGDALDH1A1TSHRGAANPSR1
SCHEMBL24019616 0.82 ALDH1A1 (0.77) HPGDALDH1A1TSHRGAANPSR1
SCHEMBL25609885 0.82 ALDH1A1 (0.58) HPGDALDH1A1TSHRGAANPSR1
SCHEMBL24210125 0.81 ALDH1A1 (0.71) HPGDALDH1A1TSHRNPSR1KMT2A
SCHEMBL24209750 0.81 ALDH1A1 (0.71) HPGDALDH1A1TSHRNPSR1KMT2A
SCHEMBL21951986 0.80 MAPT (0.71) HPGDALDH1A1TSHRGAANPSR1
SCHEMBL24209629 0.80 ALDH1A1 (0.54) HPGDALDH1A1TSHRGAANPSR1
SCHEMBL24019584 0.80 ALDH1A1 (0.70) HPGDALDH1A1TSHRNPSR1MEN1
SCHEMBL24019591 0.79 SMN1; SMN2 (0.69) HPGDALDH1A1GAANPSR1MEN1
SCHEMBL22009686 0.79 HPGD (0.67) HPGDALDH1A1TSHRNPSR1MEN1

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-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUND PROFESOR NOVOA SANTOS (ES) 2023-06-15 — — 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-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER XIAP, UBQLN1, MDM2 HPGD 2761/4885ALDH1A1 1206/4885TSHR 4635/4885

“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.

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