SCHEMBL6156467

SCHEMBL6156467

[NH]C(=O)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.65
NR4A1 P22736 1/20 0.62
NR4A2 P43354 1/20 0.62
NR4A3 Q92570 1/20 0.62
FFAR1 O14842 1/20 0.61
FFAR4 Q5NUL3 1/20 0.61
PTGS1 P23219 2/20 0.59
PTGS2 P35354 2/20 0.59
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
SLC6A2 P23975 1/20 0.59
CYP2C19 P33261 1/20 0.59
SLC6A3 Q01959 1/20 0.59
HIF1A Q16665 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
MAOB P27338 2/20 0.58
PARP10 Q53GL7 1/20 0.58
LTB4R Q15722 1/20 0.57
LTB4R2 Q9NPC1 1/20 0.57
SRD5A2 P31213 1/20 0.57

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
SCHEMBL1066614 0.86 FFAR1 (0.70) ALOX5NR4A1NR4A2NR4A3FFAR1
Ammonia Solution, Strong SCHEMBL27788257 0.84 FFAR1 (0.68) ALOX5NR4A1NR4A2NR4A3FFAR1
SCHEMBL4222632 0.84 FFAR1 (0.68) ALOX5NR4A1NR4A2NR4A3FFAR1
Hydrochloric Acid SCHEMBL10622121 0.84 FFAR1 (0.68) ALOX5NR4A1NR4A2NR4A3FFAR1
SCHEMBL19143628 0.83 ALOX5 (0.61) ALOX5NR4A1NR4A2NR4A3FFAR1
SCHEMBL68570 0.83 ALOX5 (0.69) ALOX5NR4A1NR4A2NR4A3FFAR1
SCHEMBL2166377 0.83 ALOX5 (0.65) ALOX5NR4A1NR4A2NR4A3FFAR1
SCHEMBL224149 0.83 ALOX5 (0.65) ALOX5NR4A1NR4A2NR4A3FFAR1
SCHEMBL1395785 0.83 PARP10 (0.68) ALOX5NR4A1NR4A2NR4A3FFAR1
Silver SCHEMBL4222635 0.83 ALOX5 (0.65) ALOX5NR4A1NR4A2NR4A3FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 US disclosed
EP-1446110-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES Structural Bioinformatics Inc. (US) 2004-08-18 EP disclosed
WO-2003032916-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES STRUCTURAL BIOINFORMATICS INC. (US) 2003-04-24 WO disclosed
WO-1995022991-A2 BLOCK COPOLYMERS NYCOMED IMAGING AS (NO) 1995-08-31 WO disclosed
EP-0014567-B1 PROCESSES FOR PREPARATION OF BETA-LACTAM COMPOUNDS ELI LILLY AND COMPANY (US) 1984-01-18 EP disclosed
US-4271305-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1981-06-02 US disclosed
US-4226986-A 7-ACYLAMINO-3-HYDROXY-3-CEPHEM COMPOUND, TRIARYL PHOSPHITE DIHALIDE ELI LILLY AND COMPANY (US) 1980-10-07 US disclosed
US-4223133-A USING A TRIARYL PHOSPHITE-HALOGEN COMPLEX ELI LILLY AND COMPANY (US) 1980-09-16 US disclosed
EP-0014567-A1 Processes for preparation of beta-lactam compounds ELI LILLY AND COMPANY (US) 1980-08-20 EP disclosed
US-4211702-A TRIARYLPHOSPHITE-HALOGEN COMPLEX HALOGENATING AGENT ELI LILLY AND COMPANY (US) 1980-07-08 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 (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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP ALOX5 3709/4885NR4A1 4643/4885NR4A2 3780/4885

“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.