SCHEMBL9604027

SCHEMBL9604027

c1ccc(-c2ccc3nc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)oc3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VSIR Q9H7M9 5/20 0.49
ALOX5 P09917 1/20 0.49
NPC1 O15118 3/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.47
RAB9A P51151 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GPR119 Q8TDV5 7/20 0.46
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
DHODH Q02127 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42

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
SCHEMBL23079774 0.95 VSIR (0.46) VSIRALOX5NPC1ALDH1A1SMN1; SMN2
SCHEMBL9604025 0.90 ALOX5 (0.49) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL9604030 0.90 ALOX5 (0.51) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL25459766 0.90 MEN1 (0.44) VSIRALOX5NPC1ALDH1A1SMN1; SMN2
SCHEMBL9603972 0.89 ALOX5 (0.53) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL23079756 0.89 VSIR (0.42) VSIRALOX5NPC1ALDH1A1SMN1; SMN2
SCHEMBL9603977 0.89 NPC1 (0.54) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL9604036 0.88 ALOX5 (0.52) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL9604035 0.87 DHODH (0.53) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1
SCHEMBL9603967 0.87 NPC1 (0.55) ALOX5NPC1ALDH1A1SMN1; SMN2MEN1

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 VSIR 3641/4885ALOX5 720/4885NPC1 4611/4885

“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.