SCHEMBL4074665

SCHEMBL4074665

CC(=O)c1ccc(-c2ccccc2F)cc1-c1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 1/20 0.54
PTPRC P08575 1/20 0.51
PTPN1 P18031 1/20 0.51
ALOX5AP P20292 1/20 0.48
FEN1 P39748 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHEK1 O14757 1/20 0.43
TNKS O95271 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
PDK2 Q15119 1/20 0.41
DHODH Q02127 4/20 0.40
PGR P06401 2/20 0.40
SLC6A9 P48067 1/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL6708324 0.85 CDC7 (0.47) ACMSDPTPRCPTPN1ALOX5APFEN1
SCHEMBL3097068 0.84 ACMSD (0.51) ACMSDPTPRCPTPN1ALOX5APFEN1
SCHEMBL1515817 0.82 CES2 (0.50) ACMSDPTPRCALOX5APFEN1ALDH1A1
SCHEMBL6189481 0.81 ACMSD (0.42) ACMSDPTPRCPTPN1ALOX5APFEN1
SCHEMBL3093451 0.81 ACMSD (0.42) ACMSDPTPRCPTPN1ALOX5APFEN1
SCHEMBL3107192 0.80 ACMSD (0.50) ACMSDPTPRCPTPN1NPSR1ALDH1A1
SCHEMBL9723098 0.78 NPSR1 (0.47) ACMSDPTPRCPTPN1NPSR1ALDH1A1
SCHEMBL1515697 0.78 ALOX5AP (0.59) ACMSDALOX5APFEN1MAPTCHEK1
SCHEMBL14934280 0.78
SCHEMBL14252244 0.76 ACMSD (0.76) ACMSDPTPRCPTPN1ALDH1A1MAPT

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-2084171-B1 IRIDIUM COMPLEX COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE OBTAINED BY USING THE SAME, AND USES OF THE DEVICE SHOWA DENKO KK (JP) 2013-04-10 EP disclosed
US-20090315454-A1 IRIDIUM COMPLEX COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE OBTAINED BY USING THE SAME, AND USES OF THE DEVICE SHOWA DENKO K.K. (JP) 2009-12-24 US disclosed
EP-2084171-A1 IRIDIUM COMPLEX COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE OBTAINED BY USING THE SAME, AND USES OF THE DEVICE Showa Denko K.K. (JP) 2009-08-05 EP disclosed
WO-2008056799-A1 IRIDIUM COMPLEX COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE OBTAINED BY USING THE SAME, AND USES OF THE DEVICE SHOWA DENKO K.K. (JP) 2008-05-15 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-20090315454-A1 IRIDIUM COMPLEX COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE OBTAINED BY USING THE SAME, AND USES OF THE DEVICE ELP1, RUVBL1, LIG1 ACMSD 4196/4885PTPRC 3728/4885PTPN1 3576/4885

“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.