SCHEMBL13620993

SCHEMBL13620993

c1ccc(-c2c3ccccc3c(-c3ccc(-c4nc5ccccc5o4)cc3)c3ccccc23)nc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 12/20 0.68
RAB9A P51151 11/20 0.68
HSD17B10 Q99714 10/20 0.68
ALDH1A1 P00352 9/20 0.68
SMN1; SMN2 Q16637 8/20 0.68
HPGD P15428 8/20 0.68
TP53 P04637 7/20 0.68
KDM4E B2RXH2 7/20 0.68
CYP1A2 P05177 1/20 0.68
CYP2C9 P11712 1/20 0.68
CYP2C19 P33261 1/20 0.68
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ATM Q13315 1/20 0.54
PKM P14618 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 3/20 0.49
HCRTR1 O43613 2/20 0.49
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL27365149 0.88 NPC1 (0.67) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL13620998 0.87 NPC1 (0.59) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL13621004 0.87 ALDH1A1 (0.53) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL13620996 0.85 NPC1 (0.50) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL13621003 0.85 NPC1 (0.50) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL1925604 0.85 NPC1 (0.63) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL1102963 0.85 NPC1 (0.52) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL13621002 0.84 NPC1 (0.58) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL4360878 0.84 NPC1 (0.61) NPC1RAB9AHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL13620964 0.84 NPC1 (0.61) NPC1RAB9AHSD17B10ALDH1A1SMN1; 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-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 3482/4885RAB9A 3100/4885HSD17B10 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.