SCHEMBL7186679

SCHEMBL7186679

CC(C)(C)ONCCCCCCCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.50
PRMT1 Q99873 1/20 0.48
TSHR P16473 5/20 0.46
LMNA P02545 2/20 0.46
NFKB1 P19838 1/20 0.46
PMP22 Q01453 1/20 0.46
ALDH1A1 P00352 3/20 0.44
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 7/20 0.43
PPARD Q03181 7/20 0.43
PPARA Q07869 7/20 0.43
HDAC11 Q96DB2 5/20 0.43
PTPN1 P18031 3/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
SLC22A8 Q8TCC7 1/20 0.43
MEN1 O00255 1/20 0.43
ESR1 P03372 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
SCHEMBL6202483 1.00 ADRA1A (0.50) ADRA1APRMT1TSHRLMNANFKB1
SCHEMBL7289421 1.00 ADRA1A (0.50) ADRA1APRMT1TSHRLMNANFKB1
SCHEMBL7286381 0.98 ADRA1A (0.47) ADRA1APRMT1TSHRLMNANFKB1
SCHEMBL7286124 0.92 TSHR (0.43) ADRA1APRMT1TSHRLMNANFKB1
SCHEMBL13290730 0.78 ADRA1A (0.55) ADRA1APRMT1TSHRLMNANFKB1
SCHEMBL9614821 0.78 POLB (0.30)
Azelaic Acid SCHEMBL27377315 0.74 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
Azelaic Acid SCHEMBL27659344 0.74 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL28284450 0.74 ADRA1A (0.52) ADRA1APRMT1TSHRLMNANFKB1
SCHEMBL16487196 0.74 TDP1 (0.69) ADRA1APRMT1TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6566330-B1 As chemical intermediate MEDICAL UNIVERSITY OF SOUTH CAROLINA FOUNDATION RESEARCH DEVELOPMENT 2003-05-20 US disclosed
US-20020137730-A1 Positively charged non-natural amino acids, methods of making and using thereof in peptides MEDICAL UNIVERSITY OF SOUTH CAROLINA 2002-09-26 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-20020137730-A1 Positively charged non-natural amino acids, methods of making and using thereof in peptides NGLY1, LNPEP, DNPEP ADRA1A 4773/4885PRMT1 420/4885TSHR 3728/4885

“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.