SCHEMBL9603949

SCHEMBL9603949

c1ccc(-c2cccc3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)oc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.47
ALOX5 P09917 1/20 0.47
ELANE P08246 2/20 0.47
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PRKDC P78527 2/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CB P42338 1/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
F2 P00734 3/20 0.38

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
SCHEMBL9603953 0.99 DHODH (0.49) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603956 0.95 DHODH (0.45) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603954 0.94 ALOX5 (0.48) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603960 0.93 ALOX5 (0.45) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603963 0.92 NPC1 (0.51) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603952 0.90 ALOX5 (0.45) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603955 0.90 ALOX5 (0.48) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603962 0.89 TNF (0.43) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603957 0.89 ALOX5 (0.44) DHODHALOX5ELANEESR1ESR2
SCHEMBL9603939 0.88 ALOX5 (0.45) DHODHALOX5ELANENPC1RAB9A

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 DHODH 1631/4885ALOX5 720/4885ELANE 1497/4885

“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.