SCHEMBL630834

SCHEMBL630834

COC(=O)c1cc2cc(OCC(=O)O)ccc2cc1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.55
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
POLB P06746 3/20 0.52
PKM P14618 1/20 0.52
BLM P54132 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PPARG P37231 4/20 0.49
NCOA2 Q15596 2/20 0.49
NCOA1 Q15788 2/20 0.49
NCOA3 Q9Y6Q9 2/20 0.49
PPARD Q03181 3/20 0.47
FFAR1 O14842 2/20 0.47
ALOX5 P09917 1/20 0.47
HSP90AA1 P07900 1/20 0.47
PPARA Q07869 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
MAOB P27338 4/20 0.45
MAOA P21397 1/20 0.45

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
SCHEMBL8204838 0.89 HDAC8 (0.53) POLBMAOBLMNAHPGDCTSV
SCHEMBL8204798 0.88 ALOX5 (0.52) MEN1KMT2AALOX5HSP90AA1MAOB
SCHEMBL629817 0.87 MEN1 (0.46) MEN1KMT2APPARGPPARDALOX5
SCHEMBL629914 0.87 MEN1 (0.44) MEN1KMT2APOLBPKMBLM
SCHEMBL7939669 0.85 LMNA (0.53) MEN1KMT2APOLBPKMBLM
SCHEMBL24767093 0.84 LMNA (0.46) FFAR4MAOBMAOALMNAHPGD
SCHEMBL5336493 0.81 MAOB (0.61) MEN1KMT2AALOX5HSP90AA1MAOB
SCHEMBL630698 0.81 MEN1 (0.57) MEN1KMT2ATDP1ALOX5HSP90AA1
SCHEMBL11563262 0.81 MAOB (0.56) POLBMAOBLMNAHPGDCTSV
SCHEMBL29376294 0.81 HDAC8 (0.52) MEN1KMT2APOLBTDP1HSP90AA1

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
EP-1963292-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-02-22 EP disclosed
US-7700633-B2 Organic compounds NOVARTIS AG (CH) 2010-04-20 US disclosed
US-20080262050-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-23 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-20080262050-A1 Organic Compounds PTPRS, PTPRO, PTPRC PTPN7 15/4885MEN1 4331/4885KMT2A 1641/4885

“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.