SCHEMBL17586351

SCHEMBL17586351

c1cc(-c2ccc(-n3c4ccccc4c4c5sc6ccccc6c5ccc43)cc2)cc(-c2cccc(-n3c4ccccc4c4c5sc6ccccc6c5ccc43)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
TP53 P04637 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PRKDC P78527 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HDAC4 P56524 1/20 0.30
LIMK1 P53667 2/20 0.30

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
SCHEMBL24676276 0.99 ALOX5 (0.37) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL24676246 0.98 KDM4E (0.39) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL24675459 0.98 KDM4E (0.39) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL24676345 0.98 KDM4E (0.39) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL16171123 0.96 ALOX5 (0.37) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL10014501 0.94 ATM (0.38) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL16171205 0.94 ALOX5 (0.37) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL17586360 0.94 ALOX5 (0.33) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL16482496 0.93 KDM4E (0.37) ALOX5KDM4EATML3MBTL1MAPT
SCHEMBL16283068 0.93 L3MBTL1 (0.40) ALOX5KDM4EATML3MBTL1MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160075718-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-03-17 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-20160075718-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CYP1A1, ARNT, PTGER1 ALOX5 130/4885KDM4E 4404/4885ATM 3243/4885

“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.