SCHEMBL10159372

SCHEMBL10159372

COc1cc(CCOc2nc(Oc3ccc4oc5ccccc5c4c3)nc(N3CCOCC3)n2)ccc1CO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALOX15 P16050 1/20 0.41
MAPT P10636 3/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 1/20 0.39
PIK3CA P42336 4/20 0.38
MTOR P42345 2/20 0.38
PIK3R1 P27986 2/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
PRKDC P78527 1/20 0.37
PDE10A Q9Y233 3/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL430136 0.93 MEN1 (0.48) MEN1KMT2AALOX15MAPTPOLB
SCHEMBL13801460 0.86 MEN1 (0.46) MEN1KMT2AALOX15MAPTGAA
SCHEMBL425744 0.79 MEN1 (0.52) MEN1KMT2AALOX15MAPTPOLB
SCHEMBL3323198 0.75 MEN1 (0.52) MEN1KMT2AALOX15MAPTPOLB
SCHEMBL13801454 0.75 MEN1 (0.51) MEN1KMT2AALOX15MAPTHTT
SCHEMBL13801457 0.74 MEN1 (0.46) MEN1KMT2AALOX15MAPTHTT
SCHEMBL13801461 0.71 MAPT (0.56) MEN1KMT2AALOX15MAPTPOLB
SCHEMBL426801 0.71 ALDH1A1 (0.45) MEN1KMT2AALOX15NPC1PDE10A
SCHEMBL13801455 0.70 MEN1 (0.43) MEN1KMT2AALOX15MAPTMTOR
SCHEMBL426524 0.68 SMN1; SMN2 (0.43) MEN1KMT2AALOX15NPC1PIK3CA

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
US-20150174132-A1 METHOD FOR TREATING B CELL REGULATED AUTOIMMUNE DISORDERS SYNTA PHARMACEUTICALS CORP (US) 2015-06-25 US disclosed
US-20120021434-A1 METHOD FOR TREATING B CELL REGULATED AUTOIMMUNE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-01-26 US disclosed
US-20110098267-A1 TOPICAL FORMULATIONS FOR THE TREATMENT OF PSORIASIS SYNTA PHARMACEUTICALS CORPORATION (US) 2011-04-28 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 (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-20110098267-A1 TOPICAL FORMULATIONS FOR THE TREATMENT OF PSORIASIS IL17A, IL23R, IL15 MEN1 4796/4885KMT2A 4300/4885ALOX15 127/4885
US-20150174132-A1 METHOD FOR TREATING B CELL REGULATED AUTOIMMUNE DISORDERS REL, NFATC1, BCL6 MEN1 3751/4885KMT2A 1509/4885ALOX15 1675/4885

“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.