SCHEMBL16190293

SCHEMBL16190293

CC(CCS)C(=O)NCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.51
PRMT1 Q99873 1/20 0.50
PLA2G2A P14555 1/20 0.44
MAPK1 P28482 1/20 0.42
FOLH1 Q04609 1/20 0.42
GSTK1 Q9Y2Q3 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
FFAR1 O14842 1/20 0.41
EPHX2 P34913 8/20 0.41
PLA2G4A P47712 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
SCHEMBL16190294 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190319 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190295 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190317 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190320 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190292 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190298 1.00 ADRA1A (0.51) ADRA1APRMT1PLA2G2AMAPK1FOLH1
SCHEMBL16190305 0.87 ADRA1A (0.55) ADRA1APRMT1PLA2G2AMAPK1GSTK1
SCHEMBL16190350 0.87 ADRA1A (0.55) ADRA1APRMT1PLA2G2AMAPK1GSTK1
SCHEMBL19388102 0.87 ADRA1A (0.55) ADRA1APRMT1PLA2G2AMAPK1GSTK1

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-9770398-B2 pH-sensitive compound, use, composition and treatment process using same L'OREAL (FR) 2017-09-26 US disclosed
US-20140316006-A1 PH-SENSITIVE COMPOUND, USE, COMPOSITION AND TREATMENT PROCESS USING SAME L'OREAL (FR) 2014-10-23 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-20140316006-A1 PH-SENSITIVE COMPOUND, USE, COMPOSITION AND TREATMENT PROCESS USING SAME KRT18, FH, DSP ADRA1A 4754/4885PRMT1 4126/4885PLA2G2A 4324/4885

“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.