SCHEMBL17036294

SCHEMBL17036294

CCc1cccc(CC)c1N(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1ccc2ccc3c(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4c(CC)cccc4CC)ccc4ccc1c2c43

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.40
PRKDC P78527 5/20 0.37
GGPS1 O95749 1/20 0.35
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.32
ATM Q13315 1/20 0.31
DRD4 P21917 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GLA P06280 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 2/20 0.30
MAPT P10636 2/20 0.30
CYP2C19 P33261 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TNKS O95271 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
PPARG P37231 1/20 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
SCHEMBL17036298 0.92 ALOX5 (0.38) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL17036263 0.91 ALOX5 (0.40) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL17036297 0.90 ALOX5 (0.37) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL17036310 0.89 ALOX5 (0.39) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL12206328 0.88 ALOX5 (0.41) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL2516572 0.86 ALOX5 (0.45) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL12206320 0.85 ALOX5 (0.44) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL17036295 0.85 ALOX5 (0.39) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL12206335 0.84 ALOX5 (0.43) ALOX5PRKDCGGPS1PIK3CDPIK3CB
SCHEMBL17036264 0.84 ALOX5 (0.39) ALOX5PRKDCGGPS1PTGES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150243892-A1 Organic Compound, Light-Emitting Element, Display Module, Lighting Module, Light-Emitting Device, Display Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-08-27 US disclosed
US-20150243892-A1 Organic Compound, Light-Emitting Element, Display Module, Lighting Module, Light-Emitting Device, Display Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-08-27 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-20150243892-A1 Organic Compound, Light-Emitting Element, Display Module, Lighting Module, Light-Emitting Device, Display Device, Electronic Device, and Lighting Device ESR1, EHD1, DDT ALOX5 1269/4885PRKDC 2644/4885GGPS1 2472/4885

“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.