SCHEMBL4050443

SCHEMBL4050443

COc1ccccc1C1=NN(c2ccccc2Br)C(=O)NC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 1/20 0.48
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
HTR7 P34969 2/20 0.39
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 2/20 0.36
CASP3 P42574 1/20 0.36
CASP6 P55212 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
CRBN Q96SW2 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL4042771 0.78 UGCG (0.46) PDCD1CD274MEN1KMT2A
SCHEMBL4042219 0.77 UGCG (0.46) PDCD1CD274MEN1KMT2AGAA
SCHEMBL4043112 0.77 CD274 (0.58) PDCD1CD274MEN1KMT2AKDM4E
SCHEMBL4041582 0.76 L3MBTL1 (0.45) PDCD1CD274MEN1KMT2AALDH1A1
SCHEMBL4041621 0.74 HTR7 (0.36) PDCD1CD274MEN1KMT2AHTR7
SCHEMBL4044542 0.73 PDCD1 (0.39) PDCD1CD274MEN1KMT2AALDH1A1
SCHEMBL6766055 0.72 CASP6 (0.41) PDCD1CD274MEN1KMT2AHTR7
SCHEMBL4040485 0.71 PDCD1 (0.42) PDCD1CD274MEN1KMT2AKDM4E
SCHEMBL27598154 0.68 PDCD1 (0.48) PDCD1CD274MEN1KMT2AKDM4E
SCHEMBL27861678 0.67 MEN1 (0.37) PDCD1CD274MEN1KMT2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1319659-B1 TRIAZINONES AND MEDICINAL USE THEREOF EISAI R&D MAN CO LTD (JP) 2009-03-11 EP disclosed
US-20060189622-A1 Pyridazinone and triazinone compounds and use thereof as pharmaceutical preparations EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-08-24 US disclosed
US-20030225081-A1 Pyridazinones and triazinones and medicinal use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-12-04 US disclosed
EP-1319659-A1 PYRIDAZINONES AND TRIAZINONES AND MEDICINAL USE THEREOF Eisai Co., Ltd. (JP) 2003-06-18 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-20030225081-A1 Pyridazinones and triazinones and medicinal use thereof GRIK1, GRIK3, GRIK2 PDCD1 3074/4885CD274 2129/4885MEN1 3727/4885
US-20060189622-A1 Pyridazinone and triazinone compounds and use thereof as pharmaceutical preparations GRIK3, GRIK1, GRIK2 PDCD1 3741/4885CD274 3053/4885MEN1 2326/4885

“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.