Sugi Predict

Sugi Predict / Compounds / SCHEMBL9603958

SCHEMBL9603958

SCHEMBL9603958

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3cccc4nc(-c5ccc(-c6cccc7c6sc6ccccc67)cc5)oc34)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.44
▸ PRKDC P78527 8/20 0.37
▸ ESR1 P03372 2/20 0.35
▸ ESR2 Q92731 2/20 0.35
▸ PIK3CD O00329 2/20 0.35
▸ PIK3CB P42338 2/20 0.35
▸ DHODH Q02127 1/20 0.34
▸ BRD4 O60885 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ BRDT Q58F21 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ PDE4C Q08493 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31

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
SCHEMBL9603961 0.94 ALOX5 (0.41) ALOX5PRKDCESR1ESR2PIK3CD
SCHEMBL9603959 0.90 ALOX5 (0.42) ALOX5PRKDCESR1ESR2PIK3CD
SCHEMBL9603896 0.88 ALOX5 (0.44) ALOX5PRKDCNPC1RAB9AKDM4E
SCHEMBL9603949 0.85 DHODH (0.47) ALOX5PRKDCESR1ESR2PIK3CD
SCHEMBL8281277 0.84 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL9603955 0.84 ALOX5 (0.48) ALOX5PRKDCESR1ESR2PIK3CD
SCHEMBL9603954 0.84 ALOX5 (0.48) ALOX5PRKDCESR1ESR2PIK3CD
SCHEMBL9603953 0.84 DHODH (0.49) ALOX5PRKDCESR1ESR2PIK3CD
SCHEMBL18086201 0.84 ALOX5 (0.59) ALOX5PRKDCPIK3CDPIK3CBBRD4
SCHEMBL12996584 0.84 ALOX5 (0.59) ALOX5PRKDCPIK3CDPIK3CBBRD4

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 720/4885PRKDC 4516/4885ESR1 99/4885

“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.