SCHEMBL582255

SCHEMBL582255

CCCNC(=O)c1ccc(NC(C)(C)C(=O)O)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
THRB P10828 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ESRRG P62508 1/20 0.44
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
EPHX2 P34913 3/20 0.40
HDAC6 Q9UBN7 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
CNR2 P34972 1/20 0.40
BRD4 O60885 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL582280 0.93 TSHR (0.47) RECQLESRRGHDAC6HPGDTMEM97
SCHEMBL582948 0.88 POLB (0.43) POLBL3MBTL1THRBRECQLTDP1
SCHEMBL1646774 0.84 GAA (0.47) KMT2AEPHX2CNR2ALDH1A1NPC1
Hydrochloric Acid SCHEMBL16823543 0.82 GAA (0.46) KMT2AEPHX2CNR2ALDH1A1NPC1
SCHEMBL581314 0.81 POLB (0.47) POLBKMT2ACNR2ALDH1A1HPGD
SCHEMBL581979 0.81 TSHR (0.45) RECQLESRRGHDAC6HPGDCRBN
SCHEMBL2407352 0.81 EPHX2 (0.44) EPHX2NR1H4
SCHEMBL28545376 0.80 AR (0.39) TDP1ESRRGKMT2AMEN1EPHX2
SCHEMBL10020939 0.79 AR (0.42) KMT2AALDH1A1NPC1RAB9A
SCHEMBL191113 0.78 DGAT1 (0.46) L3MBTL1KMT2AMEN1EPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9126962-B2 Substituted phenylcarbamoyl alkylamino arene compounds and N,N′-BIS-arylurea compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-09-08 US disclosed
US-9126962-B2 Substituted phenylcarbamoyl alkylamino arene compounds and N,N′-BIS-arylurea compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-09-08 US disclosed
US-9023869-B2 Substituted phenylcarbamoyl alkylamino arene compounds and N,N'-BIS-arylurea compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-05-05 US disclosed
US-9023869-B2 Substituted phenylcarbamoyl alkylamino arene compounds and N,N'-BIS-arylurea compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-05-05 US disclosed
US-20150031726-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds MEDIVATION TECHNOLOGIES LLC 2015-01-29 US disclosed
US-20150031726-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds MEDIVATION TECHNOLOGIES LLC 2015-01-29 US disclosed
US-8710086-B2 Substituted di-arylhydantoin and di-arylthiohydantoin compounds and methods of use thereof MEDIVATION TECHNOLOGIES, INC. (US) 2014-04-29 US disclosed
US-20130079372-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds MEDIVATION TECHNOLOGIES, INC. (US) 2013-03-28 US disclosed
US-20130079372-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds MEDIVATION TECHNOLOGIES, INC. (US) 2013-03-28 US disclosed
EP-2485804-A1 SUBSTITUTED PHENYLCARBAMOYL ALKYLAMINO ARENE COMPOUNDS AND N,N'-BIS-ARYLUREA COMPOUNDS Medivation Prostate Therapeutics, Inc. (US) 2012-08-15 EP disclosed
US-20120184580-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS OF USE THEREOF MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2012-07-19 US disclosed
US-20120184580-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS OF USE THEREOF MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2012-07-19 US disclosed
US-20120184580-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS OF USE THEREOF MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2012-07-19 US disclosed
EP-2416657-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS FOR USE THEREOF Medivation Prostate Therapeutics, Inc. (US) 2012-02-15 EP disclosed
WO-2011044327-A1 SUBSTITUTED PHENYLCARBAMOYL ALKYLAMINO ARENE COMPOUNDS AND N,N'-BIS-ARYLUREA COMPOUNDS MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2011-04-14 WO disclosed
WO-2011044327-A1 SUBSTITUTED PHENYLCARBAMOYL ALKYLAMINO ARENE COMPOUNDS AND N,N'-BIS-ARYLUREA COMPOUNDS MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2011-04-14 WO disclosed
WO-2010118354-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS FOR USE THEREOF MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2010-10-14 WO disclosed
WO-2010118354-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS FOR USE THEREOF MEDIVATION PROSTATE THERAPEUTICS, INC. (US) 2010-10-14 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 (3 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-20120184580-A1 SUBSTITUTED DI-ARYLHYDANTOIN AND DI-ARYLTHIOHYDANTOIN COMPOUNDS AND METHODS OF USE THEREOF AR, BRDT, AADAC POLB 4846/4885L3MBTL1 3362/4885THRB 466/4885
US-20130079372-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds AR, NAT1, NCOA1 POLB 2145/4885L3MBTL1 2735/4885THRB 50/4885
US-20150031726-A1 Substituted Phenylcarbamoyl Alkylamino Arene Compounds and N,N'-BIS-Arylurea Compounds AR, NAT1, NCOA1 POLB 2145/4885L3MBTL1 2735/4885THRB 50/4885

“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.