SCHEMBL2277574

SCHEMBL2277574

CCOC(=O)C(=CNc1cccc(C2OCCO2)c1)C(=O)OCC

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.60
MAPT P10636 6/20 0.50
NPSR1 Q6W5P4 4/20 0.50
KDM4E B2RXH2 4/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RECQL P46063 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
GAA P10253 4/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 2/20 0.46
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL11815771 0.81 DHODH (0.60) DHODHMAPTNPSR1KDM4EMAPK1
SCHEMBL3836474 0.81 NPC1 (0.41) DHODHMAPTMAPK1GAAMEN1
SCHEMBL2473343 0.81 KMT2A (0.55) DHODHMAPTNPSR1KDM4EMAPK1
SCHEMBL1904632 0.79 DHODH (0.73) DHODHMAPTNPSR1KDM4EMAPK1
SCHEMBL22083896 0.77 ALDH1A1 (0.43) KDM4ETDP1LMNAHTT
SCHEMBL12401737 0.77 SMN1; SMN2 (0.41) MAPTKDM4EMAPK1MEN1KMT2A
SCHEMBL10988529 0.76 DHODH (0.70) DHODHMAPTNPSR1KDM4EMAPK1
SCHEMBL4150771 0.76 DHODH (0.70) DHODHMAPTNPSR1KDM4EMAPK1
SCHEMBL1429843 0.76 DHODH (0.70) DHODHMAPTNPSR1KDM4EMAPK1
SCHEMBL1429754 0.76 DHODH (0.70) DHODHMAPTNPSR1KDM4EMAPK1

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
US-7998462-B2 Linkers for anchoring targeting ligands KEREOS, INC. (US) 2011-08-16 US disclosed
US-7998462-B2 Linkers for anchoring targeting ligands KEREOS, INC. (US) 2011-08-16 US disclosed
US-20080305037-A1 LINKERS FOR ANCHORING TARGETING LIGANDS KEREOS, INC. 2008-12-11 US disclosed
WO-2008070291-A2 IMPROVED LINKERS FOR ANCHORING TARGETING LIGANDS KEREOS, INC. (US) 2008-06-12 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 (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-20080305037-A1 LINKERS FOR ANCHORING TARGETING LIGANDS LDLR, HDLBP, FABP1 DHODH 1420/4885MAPT 2077/4885NPSR1 619/4885

“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.