SCHEMBL13621010

SCHEMBL13621010

c1cnc2ccc(-c3c4ccccc4c(-c4ccc(-c5nc6ccccc6o5)cc4)c4ccccc34)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.54
RAB9A P51151 9/20 0.54
ALDH1A1 P00352 8/20 0.54
KDM4E B2RXH2 7/20 0.54
HPGD P15428 7/20 0.54
SMN1; SMN2 Q16637 7/20 0.54
HSD17B10 Q99714 5/20 0.54
MAPT P10636 3/20 0.54
HCRTR1 O43613 2/20 0.54
USP2 O75604 1/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
CASP3 P42574 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
GRM4 Q14833 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 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
SCHEMBL13621007 0.90 NPC1 (0.51) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL15844951 0.88 NPC1 (0.63) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL4359763 0.87 NPC1 (0.51) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL13621017 0.87 ALDH1A1 (0.47) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL4355625 0.85 NPC1 (0.55) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL27365149 0.84 NPC1 (0.67) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL1102963 0.83 NPC1 (0.52) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL13620998 0.83 NPC1 (0.59) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL13645858 0.83 NPC1 (0.58) NPC1RAB9AALDH1A1KDM4EHPGD
SCHEMBL13621006 0.82 NPC1 (0.51) NPC1RAB9AALDH1A1KDM4EHPGD

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 3100/4885ALDH1A1 169/4885

“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.