SCHEMBL9603917

SCHEMBL9603917

c1ccc(-c2ccc3sc4c(-c5cccc(-c6nc7ccccc7o6)c5)cc(-c5ccccc5)cc4c3c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.46
ALDH1A1 P00352 9/20 0.46
NPC1 O15118 8/20 0.46
HPGD P15428 8/20 0.46
SMN1; SMN2 Q16637 7/20 0.46
RAB9A P51151 6/20 0.46
MAPT P10636 5/20 0.46
TP53 P04637 5/20 0.46
NFKB1 P19838 3/20 0.46
NFKB2 Q00653 3/20 0.46
RELA Q04206 3/20 0.46
GAA P10253 2/20 0.46
STAT1 P42224 2/20 0.46
LMNA P02545 1/20 0.46
GFER P55789 1/20 0.46
HSD17B10 Q99714 5/20 0.43
USP2 O75604 2/20 0.43
HCRTR1 O43613 2/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL9603925 0.96 NPC1 (0.44) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL8514091 0.93 NPC1 (0.46) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603921 0.93 NPC1 (0.46) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603916 0.90 TP53 (0.46) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603927 0.88 NPC1 (0.45) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603932 0.86 NPC1 (0.42) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603923 0.86 NPC1 (0.43) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603933 0.86 NPC1 (0.45) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL9603913 0.85 NPC1 (0.50) KDM4EALDH1A1NPC1HPGDSMN1; SMN2
SCHEMBL15290427 0.85 NPC1 (0.44) KDM4EALDH1A1NPC1HPGDSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546584-B2 Benzoxazole derivative, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-10-01 US disclosed
US-8546584-B2 Benzoxazole derivative, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-10-01 US disclosed
US-20120132896-A1 Benzoxazole Derivative, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD 2012-05-31 US disclosed
US-20120132896-A1 Benzoxazole Derivative, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD 2012-05-31 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-20120132896-A1 Benzoxazole Derivative, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device XDH, AOX1, CYP4X1 KDM4E 2142/4885ALDH1A1 112/4885NPC1 4611/4885

“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.