SCHEMBL5464015

SCHEMBL5464015

COc1ccc2c(=O)n(Cc3ccc(Br)cc3F)c(=O)oc2c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 13/20 0.46
MAPT P10636 2/20 0.45
AKR1A1 P14550 1/20 0.42
AKR1B1 P15121 1/20 0.42
CYP19A1 P11511 1/20 0.42
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
TRPA1 O75762 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL10488124 0.74 AKR1B1 (0.74) MAPTAKR1A1AKR1B1POLBKDM4E
SCHEMBL10487930 0.72 AKR1B1 (0.65) MAPTAKR1A1AKR1B1POLBKDM4E
SCHEMBL10487843 0.72 AKR1A1 (0.58) MAPTAKR1A1AKR1B1POLBKDM4E
SCHEMBL10488005 0.70 AKR1A1 (0.52) MAPTAKR1A1AKR1B1POLBKDM4E
SCHEMBL10487936 0.68 TRAP1 (0.55) MAPTAKR1A1AKR1B1KDM4EMEN1
SCHEMBL32674387 0.67 LMNA (0.45) MAPTPOLBKDM4E
SCHEMBL32674406 0.67 LMNA (0.45) MAPTPOLBKDM4E
SCHEMBL9534750 0.67 AKR1B1 (0.55) MAPTAKR1A1AKR1B1POLBKDM4E
SCHEMBL15332737 0.67 MAOB (0.49) MAPTPOLBKDM4EMEN1HPGD
SCHEMBL12907058 0.67 KDM4E (0.79) MAPTPOLBKDM4EMEN1HPGD

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-20070161631-A1 Substituted Phenoxyacetic Acids PHARMACIA & UPJOHN COMPANY 2007-07-12 US disclosed
US-20070161631-A1 Substituted Phenoxyacetic Acids PHARMACIA & UPJOHN COMPANY 2007-07-12 US disclosed
US-20070161631-A1 Substituted Phenoxyacetic Acids PHARMACIA & UPJOHN COMPANY 2007-07-12 US disclosed
US-7189749-B2 Substituted phenoxyacetic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2007-03-13 US disclosed
US-7189749-B2 Substituted phenoxyacetic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2007-03-13 US disclosed
US-7189749-B2 Substituted phenoxyacetic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2007-03-13 US disclosed
US-20050239849-A1 Useful for therapy of chronic complications arising from diabetes, such as neuropathy; may also contain an angiotensin converting enzyme inhibitor THE INSTITUTES OF PHARMACEUTICAL DISCOVERY LLC. (US) 2005-10-27 US disclosed
US-20030036558-A1 Substituted phenoxyacetic acids THE INSTITUTES OF PHARMACEUTICAL DISCOVERY LLC. 2003-02-20 US disclosed
US-6420426-B1 USED TO TREAT COMPLICATIONS FROM DIABETES MELLITUS THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2002-07-16 US 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-20070161631-A1 Substituted Phenoxyacetic Acids SLC5A2, GPR119, SLC5A1 BRAF 2273/4885MAPT 2825/4885AKR1A1 791/4885
US-20050239849-A1 Useful for therapy of chronic complications arising from diabetes, such as neuropathy; may also contain an angiotensin converting enzyme inhibitor ACE, DNPEP, AGT BRAF 1194/4885MAPT 1176/4885AKR1A1 271/4885
US-20030036558-A1 Substituted phenoxyacetic acids SLC5A2, GPR119, SLC5A1 BRAF 2273/4885MAPT 2825/4885AKR1A1 791/4885

“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.