SCHEMBL10144825

SCHEMBL10144825

COc1cc(C(=O)NC(C)Cc2ccccc2)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.67
KMT2A Q03164 3/20 0.61
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
LMNA P02545 3/20 0.57
ALDH1A1 P00352 3/20 0.56
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
HPGD P15428 1/20 0.54
HTT P42858 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54
TP53 P04637 1/20 0.53

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
SCHEMBL13257747 0.87 KMT2A (0.79) MAPK1KMT2ALMNAALDH1A1MEN1
SCHEMBL11737499 0.86 KMT2A (0.57) MAPK1KMT2ALMNAALDH1A1KDM4E
SCHEMBL25004064 0.85 KMT2A (0.54) MAPK1KMT2ALMNAALDH1A1KDM4E
SCHEMBL13753854 0.85 MAPK1 (0.61) MAPK1KMT2ALMNAALDH1A1KDM4E
SCHEMBL23489677 0.85 ROCK2 (0.62) MAPK1KMT2ARAB9ALMNAALDH1A1
SCHEMBL13753826 0.82 MAPK1 (0.76) MAPK1KMT2ALMNAALDH1A1MEN1
SCHEMBL13753783 0.82 MAPK1 (0.76) MAPK1KMT2ALMNAALDH1A1MEN1
SCHEMBL13753836 0.82 MAPK1 (0.76) MAPK1KMT2ALMNAALDH1A1MEN1
Dl-Phenylalanine SCHEMBL28584723 0.81 ALDH1A1 (0.53) MAPK1KMT2ALMNAALDH1A1KDM4E
SCHEMBL11949543 0.80 RAB9A (0.79) KMT2ANPC1RAB9ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 MAPK1 3681/4885KMT2A 1652/4885NPC1 764/4885

“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.