SCHEMBL46685

SCHEMBL46685

COC(=O)c1ccnc(Br)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.60
KDM4C Q9H3R0 2/20 0.60
KDM6B O15054 1/20 0.60
KDM5C P41229 1/20 0.60
KDM2A Q9Y2K7 1/20 0.60
KDM3A Q9Y4C1 1/20 0.60
ALOX15 P16050 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
JMJD6 Q6NYC1 1/20 0.53
HTT P42858 1/20 0.49
HPGD P15428 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 4/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47

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
SCHEMBL29584593 1.00 KDM4E (0.60) KDM4EKDM4CKDM6BKDM5CKDM2A
Hydrochloric Acid SCHEMBL40566 0.98 KDM4E (0.58) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL31705352 0.83 KDM4E (0.45) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL16107675 0.82 KDM4E (0.66) KDM4EKDM4CKDM6BKDM5CKDM2A
Hydrochloric Acid SCHEMBL582012 0.82 KDM4E (0.53) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL23380278 0.82 KDM4E (0.51) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL29587235 0.81 KDM4E (0.61) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL17761 0.81 KDM4E (0.61) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL70279 0.81 KDM4E (0.86) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL29894587 0.81 KDM4E (0.86) KDM4EKDM4CKDM6BKDM5CKDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850244-B Preparation method of topiroxostat 成都大学 2023-05-16 CN claimed
CN-115850244-A Preparation method of topiroxostat 成都大学 2023-03-28 CN claimed
EP-4747245-A1 PHARMACEUTICAL COMPOUNDS Almac Discovery Limited (GB) 2026-05-27 EP disclosed
US-12606541-B2 PPARg modulators and methods of use EISAI R&D MANAGEMENT CO., LTD. (JP) 2026-04-21 US disclosed
EP-3710428-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-25 EP disclosed
US-20260076962-A1 LANTHIONINE SYNTHETASE C-LIKE 2-BASED THERAPEUTICS NIMMUNE BIOPHARMA, INC. (US) 2026-03-19 US disclosed
US-20260041686-A1 CYTOTOXICITY TARGETING CHIMERAS FOR CCR2-EXPRESSING CELLS GLAXOSMITHKLINE IP DEV LTD (GB) 2026-02-12 US disclosed
US-20260034123-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS INC (US) 2026-02-05 US disclosed
US-20260027106-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. 2026-01-29 US disclosed
US-12521393-B2 Cytotoxicity targeting chimeras for CCR2-expressing cells GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2026-01-13 US disclosed
US-12502388-B2 Lanthionine synthetase C-like 2-based therapeutics NIMMUNE BIOPHARMA, INC. (US) 2025-12-23 US disclosed
WO-2004045508-A2 USE OF PDE4 INHIBITORS AS ADJUNCT THERAPY FOR PSYCHIATRIC DISORDERS MERCK & CO., INC. (US) 2004-06-03 WO disclosed
US-6743802-B2 ASTHMA THERAPY; ANTIINFLAMMATORY AGENTS MERCK FROSST CANADA & CO. (CA) 2004-06-01 US disclosed
US-20040102472-A1 Method of preparing inhibitors of phosphodiesterase-4 MERCK & CO., INC. 2004-05-27 US disclosed
EP-1397359-A1 1-BIARYL-1,8-NAPTHYRIDIN-4-ONE PHOSPHODIESTERASE-4 INHIBITORS Merck Frosst Canada & Co. (CA) 2004-03-17 EP disclosed
US-6677351-B2 USEFUL IN TREATMENT OF ASTHMA AND INFLAMMATION MERCK FROSST CANADA & CO. (CA) 2004-01-13 US disclosed
US-20030114478-A1 Alkyne-aryl phosphodiesterase-4 inhibitors MERCK CANADA INC. (CA) 2003-06-19 US disclosed
US-20030096829-A1 1-biaryl-1,8-naphthyridin-4-one phosphodiesterase-4 inhibitors MERCK FROSST CANADA LTD. (CA) 2003-05-22 US disclosed
WO-2003018579-A1 ALKYNE-ARYL PHOSPHODIESTERASE-4 INHIBITORS MERCK FROSST CANADA & CO. (CA) 2003-03-06 WO disclosed
WO-2002094823-A1 1-BIARYL-1,8-NAPTHYRIDIN-4-ONE PHOSPHODIESTERASE-4 INHIBITORS MERCK FROSST CANADA & CO. (CA) 2002-11-28 WO 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 (9 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-20260034123-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK1, CDK20 KDM4E 3048/4885KDM4C 2357/4885KDM6B 2206/4885
US-20260027106-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 KDM4E 390/4885KDM4C 549/4885KDM6B 260/4885
US-20040102472-A1 Method of preparing inhibitors of phosphodiesterase-4 PDE4B, PDE4A, PDE5A KDM4E 467/4885KDM4C 382/4885KDM6B 730/4885
US-20030096829-A1 1-biaryl-1,8-naphthyridin-4-one phosphodiesterase-4 inhibitors PDE4A, PDE4B, PDE7A KDM4E 1159/4885KDM4C 1350/4885KDM6B 2836/4885
US-12502388-B2 Lanthionine synthetase C-like 2-based therapeutics LANCL2, CBS, LCP2 KDM4E 3829/4885KDM4C 4045/4885KDM6B 3640/4885
US-20030114478-A1 Alkyne-aryl phosphodiesterase-4 inhibitors PDE4A, PDE3B, PDE4B KDM4E 318/4885KDM4C 315/4885KDM6B 436/4885
US-20260041686-A1 CYTOTOXICITY TARGETING CHIMERAS FOR CCR2-EXPRESSING CELLS CCR2, CCR1, CCRL2 KDM4E 3335/4885KDM4C 1308/4885KDM6B 1070/4885
US-20260076962-A1 LANTHIONINE SYNTHETASE C-LIKE 2-BASED THERAPEUTICS SCLY, CLCN2, CBS KDM4E 2045/4885KDM4C 2223/4885KDM6B 1893/4885
US-12606541-B2 PPARg modulators and methods of use PPARG, PPARA, PPARD KDM4E 2304/4885KDM4C 2717/4885KDM6B 1892/4885

“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.