SCHEMBL5099239

SCHEMBL5099239

COC(=O)c1cc(N)cc(-c2ccccc2Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.47
PDK2 Q15119 3/20 0.43
TSHR P16473 1/20 0.42
SLC6A3 Q01959 1/20 0.41
PRKDC P78527 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
PTPRC P08575 1/20 0.41
PTPRF P10586 1/20 0.41
PTPN1 P18031 1/20 0.41
CDC25B P30305 1/20 0.41
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
EGFR P00533 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL2204744 0.83 ATAD2 (0.47) ATAD2TSHRPTPRCPTPN1HPGD
SCHEMBL2723920 0.80 TSHR (0.53) ATAD2TSHRPRKDCCA12CA1
SCHEMBL8410461 0.79 ATAD2 (0.60) ATAD2TSHRPRKDCCA12CA1
SCHEMBL27086299 0.74 ATAD2 (0.45) ATAD2PRKDCMAPTNPC1RAB9A
SCHEMBL29920221 0.74 ATAD2 (0.45) ATAD2PRKDCMAPTNPC1RAB9A
SCHEMBL654773 0.74 CA1 (0.58) ATAD2TSHRCA12CA1CA2
SCHEMBL111187 0.74 CA12 (0.58) ATAD2TSHRCA12CA1CA2
SCHEMBL8410464 0.73 ATAD2 (0.55) ATAD2TSHRPRKDCCA12CA1
SCHEMBL3659810 0.73 MAPT (0.50) MAPTNPC1RAB9AALDH1A1MEN1
SCHEMBL6759325 0.73 ATAD2 (0.41) ATAD2PDK2TSHRPRKDCCA12

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-7446222-B2 Phenyl compounds GLAXO GROUP LIMITED (GB) 2008-11-04 US disclosed
US-20060235057-A1 Phenyl compounds GLAXO GROUP LIMITED (GB) 2006-10-19 US disclosed
EP-1556330-A2 PHENYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-07-27 EP disclosed
WO-2004039753-A2 PHENYL COMPOUNDS GLAXO GROUP LIMITED (GB) 2004-05-13 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-20060235057-A1 Phenyl compounds RXRB, CYP2C9, RXFP1 ATAD2 2965/4885PDK2 1285/4885TSHR 213/4885

“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.