SCHEMBL13621018

SCHEMBL13621018

c1ccc2oc(-c3ccc(-c4c5ccccc5c(-c5cccc6nnccc56)c5ccccc45)cc3)nc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.47
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 5/20 0.47
HPGD P15428 5/20 0.47
HSD17B10 Q99714 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
TP53 P04637 2/20 0.47
RAB9A P51151 6/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ATM Q13315 1/20 0.47
MAPT P10636 4/20 0.42
USP2 O75604 2/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HCRTR1 O43613 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL13621021 0.86 NPC1 (0.50) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13621006 0.85 NPC1 (0.51) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL4359314 0.85 NPC1 (0.54) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13134564 0.84 ATR (0.44) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13621000 0.83 NPC1 (0.56) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13620995 0.82 ALDH1A1 (0.50) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13621020 0.82 NPC1 (0.48) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL27365149 0.82 NPC1 (0.67) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13620986 0.80 NPC1 (0.51) NPC1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13621001 0.80 ALDH1A1 (0.50) NPC1ALDH1A1KDM4EHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 US disclosed
US-8859108-B2 Benzoxazole derivative, and light-emitting element, light-emitting device, and electronic device using the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-10-14 US disclosed
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABARATORY CO., LTD. 2009-11-19 US disclosed
US-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same SEMICONDUCTOR ENERGY LABARATORY CO., LTD. 2009-11-19 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-20090286985-A1 Benzoxazole Derivative, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Same CYP4X1, XDH, GABRA5 NPC1 3482/4885ALDH1A1 169/4885KDM4E 2877/4885

“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.