SCHEMBL9604020

SCHEMBL9604020

Cc1ccc2nc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)oc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.55
RAB9A P51151 11/20 0.55
HSD17B10 Q99714 6/20 0.52
KDM4E B2RXH2 8/20 0.52
HPGD P15428 8/20 0.52
SMN1; SMN2 Q16637 8/20 0.52
ALDH1A1 P00352 7/20 0.52
MAPT P10636 5/20 0.52
TP53 P04637 4/20 0.51
PKM P14618 1/20 0.51
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MEN1 O00255 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
SCHEMBL9604014 0.91 KDM4E (0.61) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL9604027 0.87 VSIR (0.49) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL9604022 0.87 ALOX5 (0.49) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL9604044 0.86 NPC1 (0.52) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL9603967 0.86 NPC1 (0.55) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL23079774 0.85 VSIR (0.46) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603977 0.85 NPC1 (0.54) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL23079699 0.84 NPC1 (0.54) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL9604030 0.84 ALOX5 (0.51) NPC1RAB9AHSD17B10KDM4EHPGD
SCHEMBL25459766 0.84 MEN1 (0.44) NPC1RAB9AKDM4EHPGDSMN1; 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 NPC1 4611/4885RAB9A 3002/4885HSD17B10 1222/4885

“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.