SCHEMBL6718334

SCHEMBL6718334

CCOC(=O)C(C)c1cccc(O)c1OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA7 P43166 2/20 0.49
CA9 Q16790 2/20 0.49
CA14 Q9ULX7 2/20 0.49
GAA P10253 3/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NLRP3 Q96P20 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
LMNA P02545 2/20 0.38

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
SCHEMBL5379799 0.89 CA1 (0.47) CA12CA1CA2CA7CA9
SCHEMBL490582 0.84 CA1 (0.51) CA12CA1CA2CA7CA9
SCHEMBL10858287 0.83 TSHR (0.53) CA12CA1CA2CA7CA9
SCHEMBL31074064 0.83 TSHR (0.53) CA12CA1CA2CA7CA9
SCHEMBL6513441 0.83 KMT2A (0.40) CA12CA1CA2CA7CA9
SCHEMBL11683620 0.81 CA12 (0.49) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL6529869 0.78 MAPK1 (0.48) MAPTALDH1A1NLRP3TSHRMAPK1
SCHEMBL5598897 0.78 CA1 (0.57) CA12CA1CA2CA7CA9
SCHEMBL490336 0.77 MAPT (0.44) MAPTALDH1A1KDM4ETSHRLMNA
SCHEMBL16953802 0.77 TSHR (0.44) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 CA12 3105/4885CA1 3246/4885CA2 2273/4885

“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.