SCHEMBL4119504

SCHEMBL4119504

CC(=O)OCC(=O)Nc1cccc(C)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.63
NPC1 O15118 5/20 0.63
MAPT P10636 1/20 0.63
TSHR P16473 2/20 0.61
TP53 P04637 2/20 0.59
HSD17B10 Q99714 1/20 0.59
SMN1; SMN2 Q16637 3/20 0.57
LMNA P02545 2/20 0.56
ALOX15 P16050 1/20 0.56
CASP3 P42574 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
ALDH1A1 P00352 1/20 0.53
POLB P06746 1/20 0.53
KMT2A Q03164 1/20 0.53
GRM5 P41594 1/20 0.53
CHRNB2 P17787 1/20 0.51
CHRNB4 P30926 1/20 0.51
CHRNA3 P32297 1/20 0.51
CHRNA4 P43681 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
SCHEMBL10665125 0.81 RAB9A (0.66) RAB9ANPC1MAPTTSHRTP53
SCHEMBL8240316 0.79 RAB9A (0.71) RAB9ANPC1MAPTTSHRTP53
SCHEMBL13841479 0.79 RAB9A (0.68) RAB9ANPC1MAPTTSHRTP53
SCHEMBL16429429 0.79 RAB9A (0.58) RAB9ANPC1MAPTTSHRTP53
SCHEMBL30440441 0.78 RAB9A (0.66) RAB9ANPC1MAPTTSHRSMN1; SMN2
SCHEMBL2190227 0.78 RAB9A (0.66) RAB9ANPC1MAPTTSHRSMN1; SMN2
SCHEMBL9885823 0.78 ALDH1A1 (0.67) RAB9ANPC1MAPTTSHRSMN1; SMN2
SCHEMBL12461472 0.77 GAA (0.65) RAB9ANPC1TP53HSD17B10SMN1; SMN2
SCHEMBL49953 0.77 RAB9A (0.75) RAB9ANPC1MAPTTP53SMN1; SMN2
SCHEMBL29704545 0.77 RAB9A (0.75) RAB9ANPC1MAPTTP53SMN1; SMN2

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-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 US disclosed
EP-2017275-A1 BENZISOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-01-21 EP 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 RAB9A 2656/4885NPC1 643/4885MAPT 4157/4885

“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.