SCHEMBL6486683

SCHEMBL6486683

CCOC(=O)/C(=C/c1cc(OC)c(OC)cc1OC)CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
MAPT P10636 5/20 0.45
LMNA P02545 3/20 0.45
POLB P06746 2/20 0.45
PLIN1 O60240 1/20 0.45
PLIN5 Q00G26 1/20 0.45
ABHD5 Q8WTS1 1/20 0.45
ALDH1A1 P00352 8/20 0.44
KDM4E B2RXH2 6/20 0.44
TDP1 Q9NUW8 2/20 0.44
HPGD P15428 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PKM P14618 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
RAB9A P51151 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 2/20 0.42
NFE2L2 Q16236 1/20 0.42

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
SCHEMBL6486687 1.00 MEN1 (0.45) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL10395152 0.90 LMNA (0.41) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL11160234 0.81 MAPT (0.66) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL10395173 0.80 KMT2A (0.45) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL9126796 0.80 LMNA (0.52) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL9126786 0.80 LMNA (0.52) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL29279594 0.77 LMNA (0.44) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL27368417 0.77 LMNA (0.44) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL6523258 0.76 PRKDC (0.49) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6523261 0.76 PRKDC (0.49) MEN1KMT2AMAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951870-B2 Coumarin derivatives with COMT inhibiting activity ORION CORPORATION (FI) 2005-10-04 US disclosed
US-20040110750-A9 Coumarin derivatives with comt inhibiting activity ORION CORPORATION (FI) 2004-06-10 US disclosed
EP-1301503-B1 COUMARIN DERIVATIVES WITH COMT INHIBITING ACTIVITY ORION CORP (FI) 2004-02-25 EP disclosed
US-20030186975-A1 Coumarin derivatives with comt inhibiting activity PYSTYNEN JARMO (FI) 2003-10-02 US disclosed
EP-1301503-A1 COUMARIN DERIVATIVES WITH COMT INHIBITING ACTIVITY ORION CORPORATION (FI) 2003-04-16 EP disclosed
WO-2002002548-A1 COUMARIN DERIVATIVES WITH COMT INHIBITING ACTIVITY ORION CORPORATION (FI) 2002-01-10 WO 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 (2 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-20040110750-A9 Coumarin derivatives with comt inhibiting activity COMT, CYP1A1, CYP2D6 MEN1 3772/4885KMT2A 2987/4885MAPT 2880/4885
US-20030186975-A1 Coumarin derivatives with comt inhibiting activity COMT, CYP1A1, CYP2D6 MEN1 3772/4885KMT2A 2987/4885MAPT 2880/4885

“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.