SCHEMBL5578233

SCHEMBL5578233

COc1ccc(Cn2cc(NC(=O)c3c(F)cccc3F)c(-c3nc(C(=O)O)c(CC(C)C)[nH]3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
BRPF1 P55201 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
ALB P02768 1/20 0.35
IL2 P60568 1/20 0.35
PDE6D O43924 2/20 0.35
MARK4 Q96L34 1/20 0.35
CACNA1G O43497 1/20 0.35
CACNA1H O95180 1/20 0.35
CACNA1I Q9P0X4 1/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 2/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL5578146 0.91 LMNA (0.35) KMT2ABRPF1MARK4LMNARAB9A
SCHEMBL5578208 0.88 IRAK4 (0.39) KMT2AMEN1RAB9AMAPTALDH1A1
SCHEMBL5578103 0.81 BRPF1 (0.46) KMT2ABRPF1ADORA3CACNA1GCACNA1H
SCHEMBL5578357 0.78 MAPT (0.39) KMT2ABRPF1ADORA3MEN1LMNA
SCHEMBL5578064 0.78 ADORA3 (0.39) KMT2ABRPF1ADORA3CACNA1GCACNA1H
SCHEMBL5578217 0.77 MAPT (0.36) KMT2ABRPF1ADORA3POLBMEN1
SCHEMBL14511672 0.76 BRPF1 (0.46) KMT2ABRPF1ADORA3CACNA1GCACNA1H
SCHEMBL5578142 0.75 BRPF1 (0.47) BRPF1ADORA3CACNA1GCACNA1HCACNA1I
SCHEMBL5578304 0.74 BRPF1 (0.46) KMT2ABRPF1ADORA3CACNA1GCACNA1H
SCHEMBL5578218 0.73 AURKA (0.44) LMNARAB9AKDM4EALDH1A1

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
US-20070105900-A1 Pharmaceutical compounds ATEX THERAPEUTICS, LIMITED (GB) 2007-05-10 US disclosed
US-20070105900-A1 Pharmaceutical compounds ATEX THERAPEUTICS, LIMITED (GB) 2007-05-10 US disclosed
EP-1648449-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS PROTEIN KINASES INHIBITORS Astex Therapeutics Limited (GB) 2006-04-26 EP disclosed
WO-2005002576-A2 IMIDAZOLE DERIVATIVES AND THEIR USE AS PROTEIN KINASES INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2005-01-13 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 (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-20070105900-A1 Pharmaceutical compounds AURKA, AURKC, CDK1 KMT2A 1706/4885BRPF1 4778/4885ADORA3 1514/4885

“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.