SCHEMBL2467110

SCHEMBL2467110

O=C(O)c1cc(-c2ccc(-c3ccccc3)cc2)nc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 9/20 1.00
KDM4E B2RXH2 2/20 0.93
PDE10A Q9Y233 2/20 0.93
LMNA P02545 1/20 0.93
SMN1; SMN2 Q16637 1/20 0.93
POLB P06746 1/20 0.82
TP53 P04637 1/20 0.75
CYP1A2 P05177 1/20 0.75
CYP2C19 P33261 1/20 0.75
HIF1A Q16665 1/20 0.75
HSD17B10 Q99714 1/20 0.75
AKR1C3 P42330 1/20 0.73
AKR1C2 P52895 1/20 0.73
AKR1C1 Q04828 1/20 0.73
KMT2A Q03164 1/20 0.70

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
SCHEMBL29536364 1.00 DHODH (1.00) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL29376617 0.97 KDM4E (1.00) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL25519 0.97 KDM4E (1.00) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL7588217 0.97 KDM4E (1.00) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL4805149 0.95 KDM4E (0.97) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL10757475 0.95 KDM4E (0.97) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL4464779 0.95 KDM4E (0.97) DHODHKDM4EPDE10ALMNASMN1; SMN2
Cinchophen SCHEMBL27543969 0.93 KDM4E (0.93) DHODHKDM4EPDE10ALMNASMN1; SMN2
SCHEMBL3237037 0.90 POLB (1.00) DHODHKDM4EPDE10ALMNASMN1; SMN2
SCHEMBL8689228 0.90 DHODH (0.82) DHODHKDM4EPDE10ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117050110-A GPX4 and DHODH double-inhibition small molecule prodrug compound based on mitochondrial targeting and preparation method and application thereof 厦门大学 2023-11-14 CN claimed
US-20110224147-A1 METHODS AND COMPOSITIONS Relevare Aust. Pyt. Ltd. (AU) 2011-09-15 US claimed
US-20100316678-A1 COMBINATION METHODS AND COMPOSITIONS FOR TREATMENT OF NEUROPATHIC PAIN CNSBIO PTY LTD. (AU) 2010-12-16 US claimed
EP-2175886-A1 COMBINATION METHODS AND COMPOSITIONS FOR TREATMENT OF NEUROPATHIC PAIN CNSBio Pty Ltd (AU) 2010-04-21 EP claimed
WO-2010012043-A1 METHODS AND COMPOSITIONS CNSBIO PTY LTD (AU) 2010-02-04 WO claimed
WO-2009000038-A1 COMBINATION METHODS AND COMPOSITIONS FOR TREATMENT OF NEUROPATHIC PAIN CNSBIO PTY LTD (AU) 2008-12-31 WO claimed
CN-117327011-A Quinoline PCSK9 inhibitor and preparation method and application thereof 山东省分析测试中心 2024-01-02 CN disclosed
CN-117050110-A GPX4 and DHODH double-inhibition small molecule prodrug compound based on mitochondrial targeting and preparation method and application thereof 厦门大学 2023-11-14 CN disclosed
US-20220288028-A1 A THERAPEUTIC APPROACH FOR TREATING NON-INFECTIOUS OCULAR IMMUNOINFLAMMATORY DISORDERS THE SCHEPENS EYE RESEARCH INSTITUTE, INC. 2022-09-15 US disclosed
WO-2021016464-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER CITY OF HOPE (US) 2021-01-28 WO disclosed
WO-2020243496-A1 A THERAPEUTIC APPROACH FOR TREATING NON-INFECTIOUS OCULAR IMMUNOINFLAMMATORY DISORDERS THE SCHEPENS EYE RESEARCH INSTITUTE, INC. (US) 2020-12-03 WO disclosed
US-20110224147-A1 METHODS AND COMPOSITIONS Relevare Aust. Pyt. Ltd. (AU) 2011-09-15 US disclosed
US-20100316678-A1 COMBINATION METHODS AND COMPOSITIONS FOR TREATMENT OF NEUROPATHIC PAIN CNSBIO PTY LTD. (AU) 2010-12-16 US disclosed
EP-2021005-A1 METHODS AND COMPOSITION FOR TREATMENT OF INFLAMMATORY PAIN CNSBIO PTY LTD (AU) 2009-02-11 EP disclosed
WO-2009000038-A1 COMBINATION METHODS AND COMPOSITIONS FOR TREATMENT OF NEUROPATHIC PAIN CNSBIO PTY LTD (AU) 2008-12-31 WO disclosed
WO-2007128056-A1 METHODS AND COMPOSITION FOR TREATMENT OF INFLAMMATORY PAIN CNSBIO PTY LTD (AU) 2007-11-15 WO disclosed
US-5032597-A Antitumor DU PONT MERCK PHARMACEUTICAL (US) 1991-07-16 US disclosed
EP-0133244-B1 PHENYLQUINOLINECARBOXYLIC ACIDS AND DERIVATIVES AS ANTITUMOR AGENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-12-05 EP disclosed
US-4680299-A ANTITUMOR AGENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-07-14 US disclosed
EP-0133244-A2 Phenylquinolinecarboxylic acids and derivatives as antitumor agents E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-02-20 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 (2 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-20110224147-A1 METHODS AND COMPOSITIONS OPRK1, OPRL1, OPRM1 DHODH 3300/4885KDM4E 1986/4885PDE10A 3536/4885
US-20220288028-A1 A THERAPEUTIC APPROACH FOR TREATING NON-INFECTIOUS OCULAR IMMUNOINFLAMMATORY DISORDERS MSR1, LTB4R2, LTB4R DHODH 2333/4885KDM4E 4843/4885PDE10A 2805/4885

“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.