SCHEMBL18118643

SCHEMBL18118643

O=c1oc2cccc(O)c2c(O)c1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.55
MAPT P10636 5/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
ALOX15 P16050 3/20 0.55
MAPK1 P28482 3/20 0.55
HPGD P15428 2/20 0.55
KDM4E B2RXH2 2/20 0.55
HSD17B10 Q99714 2/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55
AR P10275 7/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP1A1 P04798 1/20 0.51
CYP1A2 P05177 1/20 0.51
PKM P14618 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP1B1 Q16678 1/20 0.51
FTO Q9C0B1 1/20 0.51

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
SCHEMBL11479865 0.97 CYP3A4 (0.58) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL29038494 0.80 MEN1 (0.63) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL29466790 0.77 MAOB (0.70) CYP3A4MEN1KMT2AALOX15MAPK1
SCHEMBL669375 0.77 MAOB (0.70) CYP3A4MEN1KMT2AALOX15MAPK1
SCHEMBL31457155 0.76 MAOA (0.52) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL471846 0.76 MAOA (0.52) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL31344371 0.74 MEN1 (0.62) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL1607111 0.74 MEN1 (0.62) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL11477475 0.73 ADORA3 (0.53) CYP3A4MAPTMEN1KMT2AALOX15
SCHEMBL8945325 0.73 AKR1C3 (0.44) MAPTHPGDKDM4ELMNAAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287549-A1 NOVEL METHODS FOR TREATING NEURODEGENERATIVE DISEASES GENZYME CORPORATION 2016-10-06 US disclosed
US-20160287549-A1 NOVEL METHODS FOR TREATING NEURODEGENERATIVE DISEASES GENZYME CORPORATION 2016-10-06 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-20160287549-A1 NOVEL METHODS FOR TREATING NEURODEGENERATIVE DISEASES DHODH, DLD, HAGH CYP3A4 3370/4885MAPT 110/4885MEN1 4519/4885

“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.