SCHEMBL9603938

SCHEMBL9603938

Cc1ccc2nc(-c3ccc(-c4cccc5c4sc4ccccc45)cc3)oc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.52
RAB9A P51151 11/20 0.52
KDM4E B2RXH2 7/20 0.49
HPGD P15428 7/20 0.49
SMN1; SMN2 Q16637 7/20 0.49
ALDH1A1 P00352 7/20 0.49
MAPT P10636 5/20 0.49
HSD17B10 Q99714 5/20 0.49
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47
TP53 P04637 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46

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
SCHEMBL9603930 0.91 KDM4E (0.57) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603934 0.88 ALOX5 (0.46) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603948 0.88 VSIR (0.47) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL8512669 0.86 NPC1 (0.50) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603950 0.85 ALOX5 (0.48) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603887 0.85 NPC1 (0.49) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603963 0.84 NPC1 (0.51) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL25459868 0.83 GPR119 (0.43) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL25459695 0.82 ALOX5 (0.46) NPC1RAB9AKDM4EHPGDSMN1; SMN2
SCHEMBL9603889 0.81 NPC1 (0.48) 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 3002/4885KDM4E 2142/4885

“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.