SCHEMBL2519991

SCHEMBL2519991

O=C(O)c1cc2n(n1)CCCN(S(=O)(=O)c1ccccc1[N+](=O)[O-])C2

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.54
▸ LMNA P02545 2/20 0.49
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ EPHX2 P34913 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL30502812 1.00 ALDH1A1 (0.54) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL26890594 0.92 ALDH1A1 (0.54) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL25433999 0.91 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL25434818 0.88 ALDH1A1 (0.50) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL30502815 0.86 PKM (0.47) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL2520783 0.86 PKM (0.47) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL31217219 0.86 ALDH1A1 (0.47) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL30502819 0.86 PKM (0.47) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL25433441 0.84 ALDH1A1 (0.54) ALDH1A1LMNAMEN1KMT2AHTT
SCHEMBL25434397 0.83 ALDH1A1 (0.56) ALDH1A1LMNAMEN1KMT2AHTT

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12624052-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2026-05-12 — — US disclosed
US-20260008789-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS INC (US) 2026-01-08 — — US disclosed
US-12421254-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2025-09-23 — — US disclosed
US-20250243222-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2025-07-31 — — US disclosed
US-20250051365-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2025-02-13 — — US disclosed
US-20250042921-A1 KRAS MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2025-02-06 — — US disclosed
US-12145947-B2 Pyrimidine based modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-11-19 — — US disclosed
US-20240199650-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. 2024-06-20 — — US disclosed
WO-2024115890-A1 COMPOUNDS REDX PHARMA PLC (GB) 2024-06-06 — — WO disclosed
US-11912723-B2 KRAS modulators and uses thereof QUANTA THERAPEUTICS, INC. (US) 2024-02-27 — — US disclosed
US-20150175614-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. 2015-06-25 — — US disclosed
US-20150175614-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. 2015-06-25 — — US disclosed
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US disclosed
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US disclosed
US-8946223-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-02-03 — — US disclosed
WO-2011130163-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-20 — — WO disclosed
WO-2011130163-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-20 — — WO disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 — — US disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 — — US disclosed
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-13 — — 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 (11 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-12145947-B2 Pyrimidine based modulators and uses thereof KRAS, NRAS, DPYD ALDH1A1 1020/4885LMNA 3966/4885MEN1 2585/4885
US-20250243222-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF KRAS, NRAS, DPYD ALDH1A1 1020/4885LMNA 3966/4885MEN1 2585/4885
US-20150175614-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 ALDH1A1 828/4885LMNA 538/4885MEN1 1840/4885
US-20110251184-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 ALDH1A1 828/4885LMNA 538/4885MEN1 1840/4885
US-20260008789-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS ALDH1A1 3020/4885LMNA 3054/4885MEN1 646/4885
US-12421254-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS ALDH1A1 3153/4885LMNA 3135/4885MEN1 449/4885
US-20240199650-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF KRAS, NRAS, DPYD ALDH1A1 1020/4885LMNA 3966/4885MEN1 2585/4885
US-20250042921-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS ALDH1A1 3974/4885LMNA 3992/4885MEN1 667/4885
US-20250051365-A1 KRAS MODULATORS AND USES THEREOF KRAS, NRAS, HRAS ALDH1A1 3319/4885LMNA 2706/4885MEN1 458/4885
US-12624052-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS ALDH1A1 3044/4885LMNA 3905/4885MEN1 1379/4885
US-11912723-B2 KRAS modulators and uses thereof KRAS, NRAS, HRAS ALDH1A1 3733/4885LMNA 4214/4885MEN1 551/4885

“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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