SCHEMBL10193137

SCHEMBL10193137

CCc1ccccc1OCC(=O)OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.59
TSHR P16473 1/20 0.56
HSD17B10 Q99714 1/20 0.56
L3MBTL1 Q9Y468 4/20 0.51
MAPT P10636 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 2/20 0.50
MCL1 Q07820 1/20 0.50
HPGD P15428 1/20 0.49
ATM Q13315 1/20 0.49
LMNA P02545 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.47
POLB P06746 1/20 0.47
GLA P06280 1/20 0.47

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
SCHEMBL7335064 0.88 PPARD (0.75) PPARDTSHRHSD17B10L3MBTL1ALDH1A1
SCHEMBL10422938 0.88 PPARD (0.55) PPARDTSHRHSD17B10L3MBTL1MAPT
SCHEMBL10506317 0.87 SMN1; SMN2 (0.60) PPARDTSHRHSD17B10L3MBTL1MAPT
SCHEMBL4082498 0.86 PPARD (0.53) PPARDTSHRHSD17B10L3MBTL1MAPT
SCHEMBL6587328 0.86 PPARD (0.53) PPARDTSHRHSD17B10L3MBTL1MAPT
SCHEMBL7001693 0.86 PPARD (0.53) PPARDTSHRHSD17B10L3MBTL1MAPT
SCHEMBL8882060 0.85 L3MBTL1 (0.71) PPARDHSD17B10L3MBTL1MAPTNPSR1
SCHEMBL3259595 0.84 USP2 (0.60) TSHRHSD17B10L3MBTL1MAPTNPSR1
SCHEMBL5317080 0.84 L3MBTL1 (0.68) PPARDTSHRHSD17B10L3MBTL1MAPT
SCHEMBL6628742 0.83 PPARD (0.58) PPARDL3MBTL1MAPTNPSR1SMN1; 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-20120015052-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME LLC 2012-01-19 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-20120015052-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN P2RX3, P2RX1, P2RX2 PPARD 1564/4885TSHR 1614/4885HSD17B10 4501/4885

“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.