SCHEMBL13620988

SCHEMBL13620988

c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3ccc(-c4nc5ccccc5o4)cc3)c3ccccc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.50
ALDH1A1 P00352 7/20 0.50
HSD17B10 Q99714 6/20 0.50
HPGD P15428 6/20 0.50
RAB9A P51151 6/20 0.50
KDM4E B2RXH2 5/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
TP53 P04637 4/20 0.50
ATM Q13315 1/20 0.50
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
MAPT P10636 3/20 0.44
HCRTR1 O43613 2/20 0.44
PKM P14618 2/20 0.44
UTRN P46939 5/20 0.44
CYP1A2 P05177 1/20 0.44

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
SCHEMBL12571626 0.96 NPC1 (0.47) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL18999518 0.95 NPC1 (0.49) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL4355625 0.95 NPC1 (0.55) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL13620989 0.93 NPC1 (0.54) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL12571627 0.93 NPC1 (0.47) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL12571622 0.91 NPC1 (0.48) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL12322691 0.91 NPC1 (0.49) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL12571621 0.91 NPC1 (0.51) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL13620984 0.91 NPC1 (0.54) NPC1ALDH1A1HSD17B10HPGDRAB9A
SCHEMBL11953884 0.90 NPC1 (0.50) NPC1ALDH1A1HSD17B10HPGDRAB9A

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 169/4885HSD17B10 1467/4885

“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.