SCHEMBL21075852

SCHEMBL21075852

CCCCC(OC)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.43
ALOX5 P09917 2/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 1/20 0.38
CNR2 P34972 1/20 0.38
SLC6A4 P31645 2/20 0.38
PTGES O14684 1/20 0.37
CA4 P22748 1/20 0.37
GPR88 Q9GZN0 1/20 0.36
MLNR O43193 1/20 0.36
NR1I2 O75469 1/20 0.36
ESR1 P03372 1/20 0.36
NR3C1 P04150 1/20 0.36
PGR P06401 1/20 0.36
ADRB2 P07550 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRB1 P08588 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
ADORA3 P0DMS8 1/20 0.36

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
SCHEMBL4453544 0.90 LTA4H (0.47) LTA4HALOX5PPARGPPARACNR2
SCHEMBL11139896 0.89 SLC6A4 (0.40) LTA4HPPARGPPARASLC6A4CA4
SCHEMBL4445054 0.85 LTA4H (0.47) LTA4HCNR2SLC6A4MLNRNR1I2
SCHEMBL8032386 0.83 CSNK1E (0.46) LTA4HCNR2SLC6A4MLNRNR1I2
Hydrochloric Acid SCHEMBL25265807 0.82 LTA4H (0.41) LTA4HALOX5PPARGPPARACNR2
Bromide SCHEMBL25221846 0.82 LTA4H (0.41) LTA4HALOX5PPARGPPARACNR2
SCHEMBL11143140 0.82 CA4 (0.44) LTA4HPPARGPPARASLC6A4CA4
SCHEMBL27225882 0.79 LTA4H (0.47) LTA4HALOX5PPARGPPARACNR2
SCHEMBL6695750 0.78 CHRNB2 (0.39) PPARGPPARAALDH1A1LMNACYP3A4
SCHEMBL28833769 0.78 CNR2 (0.43) ALOX5PPARGPPARACNR2PTGES

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-3458511-B1 POLYMERIC MATERIAL COMPRISING MODIFIED LIGNIN REN COM AB (SE) 2021-07-28 EP disclosed
US-10676688-B2 Composition comprising derivatized lignin for fuel production REN FUEL K2B AB (SE) 2020-06-09 US disclosed
EP-3492522-A1 POLYMERIC MATERIAL COMPRISING MODIFIED LIGNIN Ren Fuel K2B AB (SE) 2019-06-05 EP disclosed
CN-1761675-A Polymerisation catalysts INNOVENE EUROP LTD (GB) 2006-04-19 CN 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-10676688-B2 Composition comprising derivatized lignin for fuel production NOX4, DCXR, COXFA4 LTA4H 22/4885ALOX5 77/4885PPARG 308/4885

“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.