SCHEMBL796843

SCHEMBL796843

CCc1c2c(c(CC)c(C(=O)O)c1C(=O)O)Cc1c(c(CC)c3cc4c(CC)c(CC)c(CC)c(CC)c4cc3c1CC)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 3/20 0.40
LDHB P07195 3/20 0.40
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
DHODH Q02127 1/20 0.35
PRNP P04156 2/20 0.32
RXFP1 Q9HBX9 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PPARG P37231 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL797071 0.83 LDHA (0.41) LDHALDHBPOLBL3MBTL1ALDH1A1
SCHEMBL796755 0.82 CNR2 (0.33) POLBALDH1A1TSHRMAPK1RXFP1
SCHEMBL29489493 0.81 LDHA (0.44) LDHALDHBPOLBL3MBTL1ALDH1A1
SCHEMBL1444836 0.77 LDHA (0.51) LDHALDHBPOLBL3MBTL1ALDH1A1
SCHEMBL13815353 0.73 MEN1 (0.37) LDHALDHBPOLBL3MBTL1ALDH1A1
SCHEMBL29150788 0.72 ALDH1A1 (0.37) LDHALDHBALDH1A1DHODHPRNP
SCHEMBL10079139 0.71 MEN1 (0.38) LDHALDHBPOLBL3MBTL1ALDH1A1
SCHEMBL14989322 0.70 ALDH1A1 (0.36) LDHALDHBALDH1A1DHODHPRNP
SCHEMBL8573447 0.70 ALDH1A1 (0.39) LDHALDHBALDH1A1DHODHPRNP
SCHEMBL797087 0.67 LDHA (0.56) LDHALDHBALDH1A1RXFP1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP disclosed
US-7901594-B2 Electroconductivity JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2011-03-08 US disclosed
US-20030116755-A1 Polyacene derivatives and production thereof JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2003-06-26 US disclosed
EP-1262469-A1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-12-04 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-20030116755-A1 Polyacene derivatives and production thereof CBR1, HVCN1, H1-0 LDHA 2792/4885LDHB 3121/4885POLB 2555/4885

“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.