SCHEMBL4263189

SCHEMBL4263189

O=C(CC(Cc1cccc(C(F)(F)F)c1)C(=O)O)c1ccc(Br)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPT P10636 1/20 0.49
RECQL P46063 1/20 0.49
KMO O15229 1/20 0.48
FOLH1 Q04609 2/20 0.46
PIN1 Q13526 1/20 0.46
MME P08473 3/20 0.45
CPA1 P15085 1/20 0.45
PPARA Q07869 2/20 0.44
NR4A2 P43354 1/20 0.44
PPARG P37231 1/20 0.44
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44
HTR2B P41595 2/20 0.44
PDPK1 O15530 1/20 0.43
NR1I2 O75469 1/20 0.43
ADRB1 P08588 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43

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
SCHEMBL4260608 0.86 MAPT (0.48) MEN1KMT2AMAPTRECQLPIN1
SCHEMBL7321600 0.83 KMO (0.59) KMOFOLH1CPA1PPARAPPARG
SCHEMBL14309587 0.82 KMO (0.46) KMOFOLH1PIN1PPARAPPARG
SCHEMBL3961471 0.82 FOLH1 (0.62) MEN1KMT2AMAPTFOLH1PIN1
SCHEMBL3961475 0.82 FOLH1 (0.62) MEN1KMT2AMAPTFOLH1PIN1
SCHEMBL3961470 0.82 FOLH1 (0.62) MEN1KMT2AMAPTFOLH1PIN1
SCHEMBL7315058 0.81 PDPK1 (0.60) KMOFOLH1MMECPA1PPARA
SCHEMBL5808951 0.77 HTR2A (0.50) MEN1KMT2AMAPTCPA1PPARA
SCHEMBL14193135 0.77 KMO (0.41) KMOFOLH1PIN1MMECPA1
SCHEMBL5095202 0.77 PPARA (0.64) MAPTPPARAPPARGHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090082392-A1 Substituted Carboxylic Acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC 2009-03-26 US disclosed
US-7358364-B2 treatment of diabetes and/or cancer; useful in the treatment of syndrome X; capable of inhibiting Protein tyrosine phosphatase THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US disclosed
EP-1805159-A1 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2007-07-11 EP disclosed
CN-1812977-A Substituted carboxylic acids INST PHARMACEUTICAL DISCOVERY (US) 2006-08-02 CN disclosed
WO-2006050212-A1 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2006-05-11 WO disclosed
US-20060094747-A1 Substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, L.L.C. 2006-05-04 US disclosed
EP-1620420-A2 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP disclosed
US-20040266788-A1 Substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2004-12-30 US disclosed
WO-2004099168-A2 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 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-20040266788-A1 Substituted carboxylic acids PTP4A1, PTPRS, G6PC1 MEN1 2359/4885KMT2A 2771/4885MAPT 1123/4885
US-20060094747-A1 Substituted carboxylic acids PTPRS, PTPRO, PTPRJ MEN1 2928/4885KMT2A 2422/4885MAPT 1249/4885
US-20090082392-A1 Substituted Carboxylic Acids PTPRJ, PTPRS, PTPRG MEN1 3127/4885KMT2A 2575/4885MAPT 1173/4885

“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.