SCHEMBL7149462

SCHEMBL7149462

N#CC1=C(N)SC(N)=C(C#N)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.37
ALOX15 P16050 9/20 0.37
HSD17B10 Q99714 9/20 0.37
MEN1 O00255 8/20 0.37
KMT2A Q03164 8/20 0.37
KDM4E B2RXH2 8/20 0.37
HPGD P15428 6/20 0.37
GAA P10253 2/20 0.37
MAPK1 P28482 1/20 0.37
CUL4A Q13619 4/20 0.34
MAPT P10636 5/20 0.34
HTT P42858 2/20 0.34
TP53 P04637 1/20 0.34
BRCA1 P38398 3/20 0.33
USP2 O75604 2/20 0.33
ALOX12 P18054 2/20 0.33
POLB P06746 2/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL6634482 0.67 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9697990 0.63
SCHEMBL13139296 0.59
SCHEMBL1415013 0.56 KDM4E (0.30) KDM4E
SCHEMBL971225 0.56
SCHEMBL1621735 0.56
SCHEMBL17808767 0.55
SCHEMBL11830833 0.54
SCHEMBL819464 0.52
SCHEMBL12361763 0.50 ALOX15 (0.41) ALDH1A1ALOX15HSD17B10MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150196546-A1 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF CORNELL UNIVERSITY 2015-07-16 US claimed
EP-2887940-A2 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF Cornell University (US) 2015-07-01 EP claimed
WO-2014031759-A2 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF CORNELL UNIVERSITY (US) 2014-02-27 WO claimed
EP-3224263-B1 USE OF UBIQUITIN-PROTEASOME SYSTEM INHIBITORS FOR TREATMENT OF TUMORS ASSOCIATED WITH NEUROFIBROMATOSIS TYPE-2 BIOXCEL LLC (US) 2023-05-17 EP disclosed
US-10617683-B2 Inhibitors of CRL4 ubiquitin ligase and uses thereof CORNELL UNIVERSITY (US) 2020-04-14 US disclosed
US-10617683-B2 Inhibitors of CRL4 ubiquitin ligase and uses thereof CORNELL UNIVERSITY (US) 2020-04-14 US disclosed
US-10610563-B2 Use of ubiquitin-proteasome system inhibitors for treatment of tumors associated with neurofibromatosis type-2 BIOXCEL CORPORATION (US) 2020-04-07 US disclosed
US-20170360872-A1 USE OF UBIQUITIN-PROTEASOME SYSTEM INHIBITORS FOR TREATMENT OF TUMORS ASSOCIATED WITH NEUROFIBROMATOSIS TYPE-2 BIOXCEL CORPORATION (US) 2017-12-21 US disclosed
EP-3224263-A1 USE OF UBIQUITIN-PROTEASOME SYSTEM INHIBITORS FOR TREATMENT OF TUMORS ASSOCIATED WITH NEUROFIBROMATOSIS TYPE-2 Bioxcel Corporation (US) 2017-10-04 EP disclosed
WO-2016085943-A1 USE OF UBIQUITIN-PROTEASOME SYSTEM INHIBITORS FOR TREATMENT OF TUMORS ASSOCIATED WITH NEUROFIBROMATOSIS TYPE-2 RASTELLI, LUCA (US) 2016-06-02 WO disclosed
CN-104968323-A Inhibitors of CRL4 ubiquitin ligase and uses thereof UNIV CORNELL 2015-10-07 CN disclosed
US-20150196546-A1 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF CORNELL UNIVERSITY 2015-07-16 US disclosed
EP-2887940-A2 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF Cornell University (US) 2015-07-01 EP disclosed
EP-2887940-A2 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF Cornell University (US) 2015-07-01 EP disclosed
WO-2014031759-A2 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF CORNELL UNIVERSITY (US) 2014-02-27 WO disclosed
WO-2014031759-A2 INHIBITORS OF CRL4 UBIQUITIN LIGASE AND USES THEREOF CORNELL UNIVERSITY (US) 2014-02-27 WO disclosed
US-6586441-B2 2-Amino-6-benzylsulfanyl-4-thiophen-2-yl-pyridine-3,5-dicarbo -nitrile as an examplary preferred compound; Alzheimer's and Parkinson's diseases; neuroprotectors; schizophrenia, analgesics; anxiolytic agents; respiratory disorders HOFFMAN-LA ROCHE INC. 2003-07-01 US disclosed
EP-1261327-A2 ADENOSINE RECEPTOR MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2002-12-04 EP disclosed
US-20010027196-A1 Adenosine receptor ligands and their use in the treatment of disease F. HOFFMANN-LA ROCHE AG (CH) 2001-10-04 US disclosed
WO-2001062233-A2 ADENOSINE RECEPTOR MODULATORS F. HOFFMANN LA ROCHE AG (CH) 2001-08-30 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 (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-20010027196-A1 Adenosine receptor ligands and their use in the treatment of disease ADORA2A, ADORA2B, ADORA1 ALDH1A1 534/4885ALOX15 722/4885HSD17B10 3742/4885

“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.