SCHEMBL1772091

SCHEMBL1772091

CC(C)(C)c1ccc(C(=O)c2cc(F)ccc2CBr)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
SRD5A2 P31213 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
EPHX2 P34913 6/20 0.43
NR1H4 Q96RI1 4/20 0.43
MAPT P10636 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HSP90AA1 P07900 1/20 0.39
PKM P14618 1/20 0.39
HDAC1 Q13547 1/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL1773321 0.87 GSK3B (0.47) SRD5A2EPHX2
SCHEMBL1773628 0.81 MDM2 (0.46) SRD5A2MAPK1
SCHEMBL1773501 0.81 NPC1 (0.46) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1774590 0.80 GAA (0.52) GAASRD5A2TDP1SIRT1NR1H4
SCHEMBL1773490 0.79 CDC25B (0.47) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL8068763 0.78 PTPN1 (0.34) HTTALDH1A1
SCHEMBL1773388 0.78 GSK3B (0.46) GAAEPHX2SMN1; SMN2ALDH1A1
SCHEMBL1772786 0.76 MAOB (0.45)
SCHEMBL1772414 0.76 VNN1 (0.50) SRD5A2MAPTMEN1KMT2AALDH1A1
SCHEMBL18997444 0.75 SRD5A2 (0.68) GAASRD5A2SIRT1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof SANOFI-AVENTIS (FR) 2011-05-12 US disclosed
EP-2242747-A1 SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF Sanofi-Aventis (FR) 2010-10-27 EP disclosed
WO-2009097997-A1 SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF SANOFI-AVENTIS (FR) 2009-08-13 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-20110112097-A1 Substituted imidazoline-2,4-diones, process for preparation thereof, medicaments comprising these compounds and use thereof GIPR, PGC, DDC GAA 231/4885SRD5A2 166/4885TDP1 3037/4885

“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.