SCHEMBL17036268

SCHEMBL17036268

CC(C)c1cccc(C(C)C)c1N(c1cccc(-c2cccc3c2oc2ccccc23)c1)c1ccc2ccc3c(N(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4c(C(C)C)cccc4C(C)C)ccc4ccc1c2c43

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
GGPS1 O95749 1/20 0.36
PRKDC P78527 5/20 0.36
PTGES2 Q9H7Z7 1/20 0.34
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP1B1 Q16678 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
ATM Q13315 1/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
C3AR1 Q16581 1/20 0.30
PIM1 P11309 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 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
SCHEMBL17036295 0.90 ALOX5 (0.39) ALOX5GGPS1PRKDCATMPIK3CD
SCHEMBL23919261 0.89 CYP1A1 (0.34) ALOX5CYP1A1CYP1A2CYP1B1
SCHEMBL17036309 0.89 ALOX5 (0.38) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL12206426 0.87 ALOX5 (0.42) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL17036270 0.86 ALOX5 (0.41) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL2513357 0.86 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL30661182 0.86 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL17036274 0.85 ALOX5 (0.40) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL17036263 0.85 ALOX5 (0.40) ALOX5GGPS1PRKDCPTGES2CYP1A1
SCHEMBL23919260 0.84 ALDH1A1 (0.31) ALOX5

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 1269/4885GGPS1 2472/4885PRKDC 2644/4885

“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.