SCHEMBL27088373

SCHEMBL27088373

CC(C)n1cc(-c2cccc([N+](=O)[O-])c2)nn1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 14/20 0.62
▸ NFE2L2 Q16236 14/20 0.62
▸ MAPT P10636 3/20 0.50
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ SENP8 Q96LD8 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48

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
SCHEMBL27088356 0.78 KEAP1 (0.62) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL21286181 0.76 KDR (0.45) KEAP1NFE2L2NPC1RAB9ASMN1; SMN2
SCHEMBL27088365 0.76 TEK (0.45) MAPTNPC1RAB9AALDH1A1
SCHEMBL22050888 0.76 CHRNB2 (0.46) MAPT
SCHEMBL25820297 0.76 CYP19A1 (0.51) —
SCHEMBL27984026 0.75 MEN1 (0.61) KEAP1NFE2L2NPC1RAB9A
SCHEMBL19449446 0.74 CHRNB2 (0.51) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL9963176 0.74 CYP19A1 (0.66) NPC1RAB9ASMN1; SMN2
SCHEMBL13225999 0.73 KEAP1 (0.50) KEAP1NFE2L2MAPTNPC1RAB9A
SCHEMBL16515657 0.73 ALDH1A1 (0.54) KEAP1NFE2L2MAPTNPC1RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595258-B2 Heterocyclic derivatives, pharmaceutical compositions and their use in the treatment or amelioration of cancer TOLREMO THERAPEUTICS AG (CH) 2026-04-07 — — US disclosed
US-20250243191-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER TOLREMO THERAPEUTICS AG (CH) 2025-07-31 — — US disclosed
US-20240327394-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER TOLREMO THERAPEUTICS AG (CH) 2024-10-03 — — US disclosed
EP-4320109-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER Tolremo Therapeutics AG (CH) 2024-02-14 — — EP disclosed
CN-117355512-A Heterocyclic derivatives, pharmaceutical compositions and their use in the treatment or amelioration of cancer 托雷莫治疗股份公司 2024-01-05 — — CN disclosed
WO-2022214606-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER TOLREMO THERAPEUTICS AG (CH) 2022-10-13 — — 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 (3 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-12595258-B2 Heterocyclic derivatives, pharmaceutical compositions and their use in the treatment or amelioration of cancer SLC10A1, MAPT, SLC6A6 KEAP1 1383/4885NFE2L2 1030/4885MAPT 2/4885
US-20240327394-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER TP53, MAPT, SLC10A1 KEAP1 1166/4885NFE2L2 1385/4885MAPT 2/4885
US-20250243191-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER TP53, MAPT, SLC10A1 KEAP1 1166/4885NFE2L2 1385/4885MAPT 2/4885

“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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