SCHEMBL11973035

SCHEMBL11973035

O=S(=O)(Nc1ccc(N2CCOCC2)c2cccnc12)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 13/20 1.00
▸ MMP2 P08253 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ USP2 O75604 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ CREBBP Q92793 1/20 0.52
▸ TDP1 Q9NUW8 2/20 0.51
▸ G6PD P11413 1/20 0.51
▸ NFKBIA P25963 1/20 0.51
▸ AGTR1 P30556 1/20 0.51
▸ METAP2 P50579 1/20 0.51
▸ METAP1 P53582 1/20 0.51
▸ GLO1 Q04760 1/20 0.51
▸ PAX8 Q06710 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ CKS1B P61024 2/20 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
SCHEMBL17506516 0.90 SLC40A1 (0.82) SLC40A1ALDH1A1LMNAUSP2HTT
SCHEMBL30553404 0.86 SLC40A1 (0.76) SLC40A1MMP2ALDH1A1LMNAUSP2
SCHEMBL26964435 0.86 SLC40A1 (0.76) SLC40A1MMP2ALDH1A1LMNAUSP2
SCHEMBL29800803 0.85 SLC40A1 (0.74) SLC40A1ALDH1A1LMNAUSP2HTT
SCHEMBL26964203 0.85 SLC40A1 (0.74) SLC40A1ALDH1A1LMNAUSP2HTT
SCHEMBL11973763 0.85 SLC40A1 (0.74) SLC40A1CREBBPTDP1NFKBIAMEN1
SCHEMBL26964248 0.84 SLC40A1 (0.72) SLC40A1MMP2ALDH1A1LMNAUSP2
SCHEMBL30553444 0.84 SLC40A1 (0.72) SLC40A1MMP2ALDH1A1LMNAUSP2
SCHEMBL30925456 0.84 SLC40A1 (0.72) SLC40A1ALDH1A1LMNAUSP2HTT
SCHEMBL30925584 0.84 SLC40A1 (0.72) SLC40A1TDP1GLO1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3180328-A1 QUINOLINE DERIVATIVES USEFUL AS UBIQUITINATION INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2017-06-21 — — EP claimed
US-20160068490-A1 UBIQUITINATION INHIBITORS MIDCAP FINANCIAL TRUST 2016-03-10 — — US claimed
WO-2016025779-A1 QUINOLINE DERIVATIVES USEFUL AS UBIQUITINATION INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-02-18 — — WO claimed
EP-3180328-B1 QUINOLINE DERIVATIVES USEFUL AS UBIQUITINATION INHIBITORS RIGEL PHARMACEUTICALS INC (US) 2020-03-18 — — EP disclosed
US-10040766-B2 Ubiquitination inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2018-08-07 — — US disclosed
EP-3180328-A1 QUINOLINE DERIVATIVES USEFUL AS UBIQUITINATION INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2017-06-21 — — EP disclosed
EP-2675526-B1 NOVEL SULFONAMINOQUINOLINE HEPCIDIN ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2017-02-01 — — EP disclosed
US-20160068490-A1 UBIQUITINATION INHIBITORS MIDCAP FINANCIAL TRUST 2016-03-10 — — US disclosed
WO-2016025779-A1 QUINOLINE DERIVATIVES USEFUL AS UBIQUITINATION INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2016-02-18 — — WO disclosed
US-9102688-B2 Sulfonaminoquinoline hepcidin antagonists VIFOR (INTERNATIONAL) AG (CH) 2015-08-11 — — US disclosed
US-9102688-B2 Sulfonaminoquinoline hepcidin antagonists VIFOR (INTERNATIONAL) AG (CH) 2015-08-11 — — US disclosed
US-9102688-B2 Sulfonaminoquinoline hepcidin antagonists VIFOR (INTERNATIONAL) AG (CH) 2015-08-11 — — US disclosed
US-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2014-12-11 — — US disclosed
US-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2014-12-11 — — US disclosed
US-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2014-12-11 — — US disclosed
CN-103492028-A Novel sulfonaminoquinoline hepcidin antagonists VIFOR INT AG 2014-01-01 — — CN disclosed
US-20120214803-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 — — US disclosed
US-20120214803-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 — — US disclosed
US-20120214803-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 — — 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 (4 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-20120214803-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists HAMP, SLC40A1, FTH1 SLC40A1 2/4885MMP2 4474/4885ALDH1A1 3570/4885
US-20160068490-A1 UBIQUITINATION INHIBITORS MDM2, RBX1, NEDD4 SLC40A1 4627/4885MMP2 2832/4885ALDH1A1 718/4885
US-20140364424-A1 Novel Sulfonaminoquinoline Hepcidin Antagonists HAMP, SLC40A1, FTH1 SLC40A1 2/4885MMP2 4474/4885ALDH1A1 3570/4885
US-10040766-B2 Ubiquitination inhibitors MDM2, RBX1, NEDD4 SLC40A1 4627/4885MMP2 2832/4885ALDH1A1 718/4885

“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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