SCHEMBL19600789

SCHEMBL19600789

CCCCOCCc1cc(CC(=O)O)on1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.53
THRA P10827 3/20 0.39
THRB P10828 3/20 0.39
PTGS2 P35354 2/20 0.37
GAA P10253 1/20 0.37
PLA2G4B P0C869 1/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RECQL P46063 1/20 0.35
RARB P10826 1/20 0.35
CYP3A4 P08684 1/20 0.35
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34

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
SCHEMBL25930327 0.88 PPARA (0.48) PPARATHRATHRBPTGS2PLA2G4B
SCHEMBL19600796 0.86 PPARA (0.44) PPARAPTGS2GAAALDH1A1TSHR
SCHEMBL25603629 0.86 PPARA (0.65) PPARAALDH1A1HPGDHSD17B10NPC1
SCHEMBL7495621 0.83 PPARA (0.74) PPARAALDH1A1HPGDHSD17B10TSHR
SCHEMBL18256139 0.83 PPARA (0.43) PPARAGAAALDH1A1HPGDTSHR
SCHEMBL19598747 0.82 PPARA (0.56) PPARAALDH1A1HPGDTSHRNPC1
SCHEMBL19600794 0.82 PPARA (0.47) PPARATHRBALDH1A1HPGDTSHR
SCHEMBL18256072 0.77 PPARA (0.43) PPARAALDH1A1TSHRNPC1RAB9A
SCHEMBL13308736 0.76 PPARA (0.48) PPARAGAANPC1RAB9ASMN1; SMN2
SCHEMBL21405366 0.75 PPARA (0.41) PPARANPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2017-11-16 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 (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-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, MDM2, ESRRA PPARA 1884/4885THRA 1370/4885THRB 639/4885

“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.