SCHEMBL5525880

SCHEMBL5525880

O=c1nc2nc[nH]c2c[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.39
▸ PNP P00491 2/20 0.36
▸ CDK2 P24941 2/20 0.35
▸ PAK1 Q13153 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ CCNT1 O60563 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ CDK7 P50613 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ CCNH P51946 1/20 0.33
▸ GAA P10253 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.32
▸ PDPK1 O15530 1/20 0.31

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
SCHEMBL17265808 0.69 ALDH1A1 (0.52) ALDH1A1KDM4ERXFP1CDK2PAK1
SCHEMBL10401760 0.67 — —
SCHEMBL20830163 0.67 SMN1; SMN2 (0.38) ALDH1A1HTT
SCHEMBL276944 0.65 ALDH1A1 (0.59) ALDH1A1KDM4ERXFP1PNPCDK2
SCHEMBL2008297 0.65 ALDH1A1 (0.44) ALDH1A1KDM4ERXFP1PNPCDK2
SCHEMBL29452971 0.64 ALDH1A1 (0.63) ALDH1A1KDM4ERXFP1CDK2PAK1
SCHEMBL22487731 0.63 L3MBTL1 (0.42) ALDH1A1
SCHEMBL29656531 0.63 EGFR (0.32) —
SCHEMBL10402531 0.63 ALDH1A1 (0.39) ALDH1A1KDM4EPNPDPP4GAA
SCHEMBL5748057 0.62 ALDH1A1 (0.61) ALDH1A1KDM4ERXFP1CDK2PAK1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022062357-A1 MEDICINE FOR TREATING OR PREVENTING DISEASES RELATED TO ACTIVITY OF LRRK2 KINASE OR ABNORMAL LRRK2 MUTANT KINASE 广州智睿医药科技有限公司 2022-03-31 — — WO claimed
US-12601008-B2 Using hairpin formation to identify DNA and RNA sequences having a target nucleic acid sequence FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2026-04-14 — — US disclosed
US-20230419331-A1 OLIGONUCLEOTIDES REPRESENTING DIGITAL DATA NUCLEOTRACE PTY LTD (AU) 2023-12-28 — — US disclosed
CN-117136241-A Oligonucleotides representing digital data 核素示踪有限公司 2023-11-28 — — CN disclosed
US-20230348962-A1 Using Hairpin Formation To Identify DNA and RNA Sequences Having A Target Nucleic Acid Sequence FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2023-11-02 — — US disclosed
EP-4226379-A1 OLIGONUCLEOTIDES REPRESENTING DIGITAL DATA Nucleotrace Pty. Ltd. (AU) 2023-08-16 — — EP disclosed
WO-2023081373-A1 USING HAIRPIN FORMATION TO IDENTIFY DNA AND RNA SEQUENCES HAVING A TARGET NUCLEIC ACID SEQUENCE FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2023-05-11 — — WO disclosed
EP-4055162-A1 EVALUATING GENOMIC VARIATION USING REPETITIVE NUCLEIC ACID SEQUENCES Florida State University Research Foundation, Inc. (US) 2022-09-14 — — EP disclosed
CN-114641578-A Apparatus and method for biopolymer identification 通用测序技术公司 2022-06-17 — — CN disclosed
US-20220145377-A1 Device and Method for Biopolymer Identification UNIVERSAL SEQUENCING TECHNOLOGY CORPORATION 2022-05-12 — — US disclosed
WO-2022073063-A1 OLIGONUCLEOTIDES REPRESENTING DIGITAL DATA Nucleotrace Pty. Ltd. (AU) 2022-04-14 — — WO disclosed
WO-2022062357-A1 MEDICINE FOR TREATING OR PREVENTING DISEASES RELATED TO ACTIVITY OF LRRK2 KINASE OR ABNORMAL LRRK2 MUTANT KINASE 广州智睿医药科技有限公司 2022-03-31 — — WO disclosed
US-20140301947-A1 METHODS TO PREDICT BINDING AFFINITY OF TSPO IMAGING AGENTS TO TSPO IMPERIAL INNOVATIONS LIMITED (GB) 2014-10-09 — — US disclosed
EP-2718464-A1 METHODS TO PREDICT BINDING AFFINITY OF TSPO IMAGING AGENTS TO TSPO Imperial Innovations Limited (GB) 2014-04-16 — — EP disclosed
WO-2012168697-A1 METHODS TO PREDICT BINDING AFFINITY OF TSPO IMAGING AGENTS TO TSPO IMPERIAL INNOVATIONS LIMITED (GB) 2012-12-13 — — WO disclosed
WO-2007103162-A2 STRUCTURE BASED DRUG DESIGN OF STEROIDOGENESIS INHIBITORS SAMARITAN PHARMACEUTICALS, INC. (US) 2007-09-13 — — 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 (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-20140301947-A1 METHODS TO PREDICT BINDING AFFINITY OF TSPO IMAGING AGENTS TO TSPO TSPO, GPR174, TSG101 ALDH1A1 2681/4885KDM4E 4857/4885RXFP1 200/4885
US-12601008-B2 Using hairpin formation to identify DNA and RNA sequences having a target nucleic acid sequence UPF1, RNGTT, POLRMT ALDH1A1 2167/4885KDM4E 3924/4885RXFP1 3020/4885

“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.

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