SCHEMBL915213

SCHEMBL915213

CC(=O)Nc1cc([N+](=O)[O-])ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
PABPC1 P11940 1/20 0.64
DUSP3 P51452 1/20 0.64
PTPN5 P54829 1/20 0.64
PTPN11 Q06124 1/20 0.64
EIF4H Q15056 1/20 0.64
CTDSP1 Q9GZU7 1/20 0.64
CXCR1 P25024 1/20 0.62
CXCR2 P25025 1/20 0.62
KCNMA1 Q12791 1/20 0.62
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
SMN1; SMN2 Q16637 6/20 0.60
LMNA P02545 2/20 0.60
HTT P42858 1/20 0.60
GAA P10253 5/20 0.58
MAPT P10636 3/20 0.57
ALDH1A1 P00352 3/20 0.57
HPGD P15428 2/20 0.57

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
SCHEMBL2131627 0.87 CXCR1 (0.62) MEN1KMT2ACXCR1CXCR2KCNMA1
SCHEMBL31171007 0.87 CXCR1 (0.62) MEN1KMT2ACXCR1CXCR2KCNMA1
SCHEMBL1024223 0.85 CXCR2 (0.68) MEN1KMT2APABPC1DUSP3PTPN5
SCHEMBL1024222 0.85 CXCR2 (0.68) MEN1KMT2APABPC1DUSP3PTPN5
SCHEMBL11874002 0.84 CXCR1 (0.68) MEN1KMT2APABPC1DUSP3PTPN5
SCHEMBL4326710 0.83 SMN1; SMN2 (0.58) KMT2ASMN1; SMN2HTTGAAMAPT
SCHEMBL427418 0.83 HTT (0.67) MEN1KMT2ACTDSP1SMN1; SMN2LMNA
SCHEMBL11132091 0.83 MEN1 (0.59) MEN1KMT2APABPC1DUSP3PTPN5
SCHEMBL18600723 0.83 SMN1; SMN2 (0.71) MEN1KMT2APABPC1DUSP3PTPN5
SCHEMBL11733765 0.83 SMN1; SMN2 (0.64) MEN1KMT2APABPC1DUSP3PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4519997-A COMPLEXES OF TRIVALENT COBALT WITH INORGANIC LIGANDS VEB-LEUNA-WERKE "WALTER ULBRICHT" (DE) 1985-05-28 US claimed
EP-0029964-A1 Coupler components for oxidation hair dyes, their production and use, and hair dyeing compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1981-06-10 EP claimed
WO-2023031308-A1 CCR2 INHIBITORS ARTICA THERAPEUTICS B.V. (NL) 2023-03-09 WO disclosed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 US disclosed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 US disclosed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-4333730-A HAIR DYES SOCIETE ANONYME DITE: L'OREAL (FR) 1982-06-08 US disclosed
EP-0011844-B1 COUPLING COMPONENTS FOR OXIDIZING HAIR DYES, THEIR PREPARATION AND HAIR DYES CONTAINING THEM Henkel Kommanditgesellschaft auf Aktien (DE) 1982-05-26 EP disclosed
US-4330292-A CONTAINING AN OXIDATION BASE L'OREAL (FR) 1982-05-18 US disclosed
US-4314809-A BIS/2,4-DIAMINOPHENOXY/ALKANES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1982-02-09 US disclosed
EP-0029964-A1 Coupler components for oxidation hair dyes, their production and use, and hair dyeing compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1981-06-10 EP disclosed
US-4231964-A Nitroamines, processes for their manufacture and their use as diazo components HOECHST AKTIENGESELLSCHAFT (DE) 1980-11-04 US disclosed
EP-0011844-A1 Coupling components for oxidizing hair dyes, their preparation and hair dyes containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1980-06-11 EP disclosed
US-4102879-A COLORFASTNESS BASF AKTIENGESELLSCHAFT (DE) 1978-07-25 US disclosed
US-4025642-A ANTIALLERGENS SMITHKLINE CORPORATION (US) 1977-05-24 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-20130137673-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 MEN1 2502/4885KMT2A 1528/4885PABPC1 3385/4885

“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.