SCHEMBL9603964

SCHEMBL9603964

Cc1cc(C)c(-c2cccc3nc(-c4ccc(-c5cccc6c5sc5ccccc56)cc4)oc23)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
PRKDC P78527 7/20 0.40
CETP P11597 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
PIK3CD O00329 2/20 0.36
PIK3CB P42338 2/20 0.36
DHODH Q02127 1/20 0.36
MAPT P10636 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ELANE P08246 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
BRD4 O60885 1/20 0.34
PIK3CA P42336 1/20 0.34

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
SCHEMBL9603963 0.88 NPC1 (0.51) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL9603939 0.87 ALOX5 (0.45) ALOX5NPC1RAB9APRKDCCETP
SCHEMBL9603949 0.84 DHODH (0.47) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL9603955 0.84 ALOX5 (0.48) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL9603953 0.83 DHODH (0.49) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL9603957 0.83 ALOX5 (0.44) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL8281276 0.83 ALOX5 (0.46) ALOX5NPC1RAB9APRKDCMAPT
SCHEMBL9603956 0.82 DHODH (0.45) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL9603960 0.82 ALOX5 (0.45) ALOX5NPC1RAB9APRKDCESR1
SCHEMBL9603952 0.82 ALOX5 (0.45) ALOX5NPC1RAB9APRKDCESR1

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 ALOX5 720/4885NPC1 4611/4885RAB9A 3002/4885

“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.