SCHEMBL55347

SCHEMBL55347

O=Cc1c(Cl)nc(Cl)nc1Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.38
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RECQL P46063 1/20 0.34
RAB9A P51151 1/20 0.32

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
SCHEMBL11345925 0.85 LMNA (0.34) ALDH1A1ALOX15TSHRLMNAKDM4E
SCHEMBL11350854 0.83 LMNA (0.33) ALDH1A1ALOX15TSHRLMNAKDM4E
SCHEMBL5674047 0.83 KDM4E (0.37) ALDH1A1ALOX15TSHRLMNAKDM4E
SCHEMBL22024694 0.83 LMNA (0.41) ALDH1A1ALOX15TSHRLMNAKDM4E
SCHEMBL31627684 0.83 KDM4E (0.37) ALDH1A1ALOX15TSHRLMNAKDM4E
SCHEMBL29950870 0.83 LMNA (0.41) ALDH1A1ALOX15TSHRLMNAKDM4E
SCHEMBL192661 0.80 LMNA (0.55) ALDH1A1LMNAKDM4EMAPTNPSR1
SCHEMBL6066162 0.78 LMNA (0.36) ALDH1A1LMNAKDM4EMAPTNPSR1
SCHEMBL11338618 0.78 LMNA (0.36) ALDH1A1LMNAKDM4EMAPTNPSR1
SCHEMBL114532 0.78 MAPT (0.40) ALDH1A1LMNAKDM4EMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115368367-B Pyrimidinone derivative and preparation method and application thereof 中山大学 2023-10-31 CN claimed
CN-115368367-A Pyrimidone derivative and preparation method and application thereof 中山大学 2022-11-22 CN claimed
CN-110078736-B Pyrazolopyrimidine derivative, process for producing the same, and use thereof 广州白云山医药集团股份有限公司白云山制药总厂 2021-08-03 CN claimed
CN-110862394-A Preparation method of PDE9A inhibitor 广州白云山医药集团股份有限公司白云山制药总厂 2020-03-06 CN claimed
CN-110078736-A Pyrazolopyrimidine derivative, preparation method and its application 广州白云山医药集团股份有限公司白云山制药总厂 2019-08-02 CN claimed
US-9617269-B2 N-substituted pyrazolo [3,4-D] pyrimidine ketone compound, and preparation process and use thereof SUN YAT-SEN UNIVERSITY (CN) 2017-04-11 US claimed
US-20150218168-A1 N-SUBSTITUTED PYRAZOLO [3,4-D] PYRIMIDINE KETONE COMPOUND, AND PREPARATION PROCESS AND USE THEREOF SUN YAT-SEN UNIVERSITY (CN) 2015-08-06 US claimed
EP-1893585-A1 PROCESS FOR THE PREPARATION OF N-[4-(4-FLUOROPHENYL)-5-FORMYL-6-ISOPROPYL-PYRIMIDIN-2-YL]-N-METHYLMETHANESULFONAMIDE Fermion Oy (FI) 2008-03-05 EP claimed
WO-2006128954-A1 PROCESS FOR THE PREPARATION OF N-[4-(4-FLUOROPHENYL)-5-FORMYL-6-ISOPROPYL-PYRIMIDIN-2-YL]-N-METHYLMETHANESULFONAMIDE FERMION OY (FI) 2006-12-07 WO claimed
JP-59005186-A None JP disclosed
EP-4747260-A1 MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2026-05-27 EP disclosed
EP-4746963-A1 MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2026-05-27 EP disclosed
EP-4743465-A1 BICYCLIC MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2026-05-20 EP disclosed
EP-4739670-A1 MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2026-05-13 EP disclosed
US-4126609-A AZO DYESTUFF WITH A FIBER-REACTIVE GROUP ATTACHED TO A NAPHTHALENE SULPHONIC ACID COMPONENT BAYER AKTIENGESELLSCHAFT (DE) 1978-11-21 US disclosed
US-4089895-A COUPLER FOR AZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1978-05-16 US disclosed
US-4065446-A Reactive dyestuffs containing urea alkylene linkage between chromophore and reactive radical BAYER AKTIENGESELLSCHAFT (DT) 1977-12-27 US disclosed
US-4049704-A AZO REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-09-20 US disclosed
US-3989692-A PHTHALOCYANINE DYES, WOOL, SILK, POLYAMIDES, CELLULOSE BAYER AKTIENGESELLSCHAFT (DT) 1976-11-02 US disclosed
US-3957751-A WATER-SOLUBLE REACTIVE DYESTUFFS OF THE MONOAZO SERIES CONTAINING AN ACTIVE METHYLENE COUPLING COMPONENT HOECHST AKTIENGESELLSCHAFT (DT) 1976-05-18 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-20150218168-A1 N-SUBSTITUTED PYRAZOLO [3,4-D] PYRIMIDINE KETONE COMPOUND, AND PREPARATION PROCESS AND USE THEREOF PDE3B, PDE3A, PDE2A ALDH1A1 581/4885ALOX15 4280/4885TSHR 2094/4885

“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.