SCHEMBL163540

SCHEMBL163540

O=C(O)c1nccc(O)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 19/20 0.50
KDM4E B2RXH2 1/20 0.38
KDM6B O15054 1/20 0.38
TET3 O43151 1/20 0.38
KDM4A O75164 1/20 0.38
BBOX1 O75936 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
KDM5A P29375 1/20 0.38
KDM5C P41229 1/20 0.38
ASPH Q12797 1/20 0.38
KDM4D Q6B0I6 1/20 0.38
TET2 Q6N021 1/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
KDM7A Q6ZMT4 1/20 0.38
KDM8 Q8N371 1/20 0.38
TET1 Q8NFU7 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
FTO Q9C0B1 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38

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
Ammonia Solution, Strong SCHEMBL31345935 0.98 KMO (0.49) KMOKDM4EKDM6BTET3KDM4A
SCHEMBL163294 0.80 KDM4E (0.37) KMOKDM4EKDM5AKDM5CKDM5B
Hydrochloric Acid SCHEMBL8170615 0.78 SORD (0.44) KMOKDM4EALDH1A1
SCHEMBL31126262 0.77 KDM4E (0.55) KMOKDM4EKDM6BTET3KDM4A
SCHEMBL87765 0.77 KDM4E (0.55) KMOKDM4EKDM6BTET3KDM4A
SCHEMBL163539 0.77 KMO (0.50) KMO
SCHEMBL23774539 0.76 KMO (0.49) KMOKDM4EKDM6BTET3KDM4A
Fluoride SCHEMBL21332111 0.76 KDM4E (0.53) KMOKDM4EKDM6BTET3KDM4A
SCHEMBL20929040 0.76 KMO (0.49) KMO
Hydrochloric Acid SCHEMBL21173938 0.76 KDM4E (0.53) KMOKDM4EKDM6BTET3KDM4A

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
CN-117120430-A MK2 inhibitors and uses thereof 新特拉有限公司 2023-11-24 CN disclosed
WO-2023114977-A1 S1PR4 RECEPTOR ANTAGONISTS AND METHODS OF USE THEREOF TIAKI THERAPEUTICS, INC. (US) 2023-06-22 WO disclosed
US-20210214364-A1 sGC STIMULATORS CYCLERION THERAPEUTICS INC (US) 2021-07-15 US disclosed
EP-3092231-B1 SGC STIMULATORS IRONWOOD PHARMACEUTICALS INC (US) 2018-06-27 EP disclosed
US-9856210-B2 Pharmaceutical composition for prevention and treatment of amyotrophic lateral sclerosis KYOTO UNIVERSITY (JP) 2018-01-02 US disclosed
EP-2611437-B1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS UNIV KYOTO (JP) 2017-03-29 EP disclosed
EP-3092231-A1 SGC STIMULATORS Ironwood Pharmaceuticals, Inc. (US) 2016-11-16 EP disclosed
US-20160311826-A1 SGC STIMULATORS CYCLERION THERAPEUTICS, INC. 2016-10-27 US disclosed
WO-2015089182-A1 SGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2015-06-18 WO disclosed
US-20130225642-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2013-08-29 US disclosed
WO-2012029994-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2012-03-08 WO disclosed
CN-101372475-B Aromatic heterocyclic substituted diphenyl urea derivative and application thereof NANJING UNIVERSITY OF TECHNOLOGY 2012-01-04 CN disclosed
WO-2011025938-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 WO disclosed
US-20090325145-A1 METHODOLOGY FOR ANALYSIS OF SEQUENCE VARIATIONS WITHIN THE HCV NS5B GENOMIC REGION INNOGENETICS N.V. (BE) 2009-12-31 US disclosed
EP-2121990-A2 METHODOLOGY FOR ANAYSIS OF SEQUENCE VARIATIONS WITHIN THE HCV NS5B GENOMIC REGION Innogenetics N.V. (BE) 2009-11-25 EP disclosed
CN-101372475-A Aromatic heterocyclic substituted diphenyl urea derivative and application thereof NANJING UNIVERSITY OF TECHNOLOGY (CN) 2009-02-25 CN disclosed
WO-2008046922-A2 METHODOLOGY FOR ANAYSIS OF SEQUENCE VARIATIONS WITHIN THE HCV NS5B GENOMIC REGION INNOGENETICS N.V. (BE) 2008-04-24 WO disclosed
US-6337368-B1 WATER INSOLUBLE CARRIERS WITH P-NITROBENZOIC ACID, AROMATIC AMINES, AMIDES, SULFONAMIDES AND HYDRAZIDES KANEKA CORPORATION (JP) 2002-01-08 US disclosed
US-6174890-B1 A SYNERGISTIC BIOLOGICAL, NEUROMETABOLIC AND CELLTROPHIC COMPOSITION COMPRISING ANTIOXIDATIVE AND -CATABOLIC STRESS (METHIONINE),-ANABOLIC DRUGS, VASODILATIVE AND NORMO-LIPIDEMIC DRUGS (NICOTINIC ACID), ENERGOACTIVE AND ANTITOXIC RIGA DAN (RO) 2001-01-16 US disclosed
EP-1008383-A1 LIPOPROTEIN ADSORBENT AND LIPOPROTEIN ADSORBER MADE WITH THE USE OF THE SAME KANEKA CORPORATION (JP) 2000-06-14 EP 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-20130225642-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTION AND TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS SMN1; SMN2, SOD1, SOD3 KMO 2484/4885KDM4E 2214/4885KDM6B 1524/4885
US-20160311826-A1 SGC STIMULATORS GUCY1A1, GUCY1B1, GUCY1A2 KMO 1564/4885KDM4E 1072/4885KDM6B 1068/4885
US-20210214364-A1 sGC STIMULATORS GUCY1B1, GUCY1A1, GUCY1B2 KMO 2612/4885KDM4E 871/4885KDM6B 450/4885

“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.