SCHEMBL13596071

SCHEMBL13596071

C=CCOc1cc(NC)ccc1C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
FLT3 P36888 1/20 0.44
LIG1 P18858 1/20 0.43
GAA P10253 3/20 0.43
TSHR P16473 2/20 0.43
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.38
CYP3A4 P08684 2/20 0.37

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
SCHEMBL4125735 0.87 TDP1 (0.56) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL6121031 0.81 FLT3 (0.47) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL2187527 0.79 ALDH1A1 (0.50) NPC1RAB9ASMN1; SMN2FLT3LIG1
SCHEMBL3955768 0.79 FLT3 (0.66) MAPTNPC1RAB9APOLBFLT3
SCHEMBL11821446 0.79 GAA (0.62) MAPTNPC1RAB9APOLBFLT3
SCHEMBL4126877 0.79 FLT3 (0.46) MAPTPOLBSMN1; SMN2FLT3LIG1
SCHEMBL10739254 0.78 TDP1 (0.54) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL13596056 0.77 FLT3 (0.47) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL7326428 0.77 TDP1 (0.71) MAPTNPC1RAB9APOLBSMN1; SMN2
SCHEMBL1938254 0.75 ALDH1A1 (0.64) NPC1FLT3KDM4EALDH1A1HPGD

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-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 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-20090318690-A1 Benzisoxazole Compound NR1I2, NR1I3, NR0B1 MAPT 4157/4885NPC1 643/4885RAB9A 2656/4885

“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.