SCHEMBL4474107

SCHEMBL4474107

O=C(O)C(O)c1coc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.50
LMNA P02545 3/20 0.45
MAPK1 P28482 1/20 0.45
PTPN1 P18031 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.44
PKM P14618 1/20 0.44
PTPN7 P35236 1/20 0.44
BLM P54132 1/20 0.44
ESR2 Q92731 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ADORA2B P29275 1/20 0.43
HSD17B2 P37059 1/20 0.43
CMA1 P23946 1/20 0.41
MAOA P21397 2/20 0.40
PSMB5 P28074 3/20 0.38
PSMB8 P28062 2/20 0.38
PTGS2 P35354 1/20 0.38
ALDH1A1 P00352 1/20 0.38
FTO Q9C0B1 1/20 0.37

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
SCHEMBL5762115 0.80 MAOB (0.49) MAOBPOLBADORA2BHSD17B2CMA1
SCHEMBL5763478 0.80 MAOB (0.49) MAOBPTPN1KMT2AADORA2BHSD17B2
SCHEMBL11500782 0.79 PSMB5 (0.48) MAOBLMNAMAPK1KMT2AL3MBTL1
SCHEMBL12987640 0.77 MAOB (0.56) MAOBLMNAMAOAPSMB5PSMB8
SCHEMBL4139411 0.76 MAOB (0.45) MAOBKMT2AADORA2BHSD17B2PSMB5
SCHEMBL24898027 0.75 MAOB (0.43) MAOBLMNAPTPN1L3MBTL1ADORA2B
SCHEMBL28394138 0.75 MAOB (0.43) MAOBPTPN1ADORA2BHSD17B2CMA1
SCHEMBL28392768 0.75 MAOB (0.43) MAOBPTPN1ADORA2BHSD17B2CMA1
SCHEMBL2960730 0.75 MAOB (0.43) MAOBPTPN1ADORA2BHSD17B2CMA1
SCHEMBL12911148 0.74 CMA1 (0.44) MAOBADORA2BHSD17B2CMA1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7528160-B2 Fused heterocyclic derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2009-05-05 US disclosed
US-20060217374-A1 Fused heterocyclic derivates as ppar modulators ELI LILLY AND COMPANY 2006-09-28 US disclosed
EP-1581521-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-10-05 EP disclosed
WO-2004063190-A1 FUSED HETEROCYCLIC DERIVATES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed
US-4871864-A Carbamoyloxythiophene fungicides BAYER AKTIENGESELLSCHAFT (DE) 1989-10-03 US disclosed
US-4839381-A FUNGICIDES, PESTICIDES; RICE PLANTS BAYER AKTIENGESELLSCHAFT (DE) 1989-06-13 US disclosed
US-4757085-A Pharmaceuticals BAYER AKTIENGESELLSCHAFT (DE) 1988-07-12 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-20060217374-A1 Fused heterocyclic derivates as ppar modulators PPARG, PPARA, PPARD MAOB 2020/4885LMNA 1396/4885MAPK1 1653/4885

“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.