SCHEMBL1952892

SCHEMBL1952892

OC(Br)CCCCCNc1ccc2cccc3c4cccc5cccc(c1c23)c54

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.40
▸ HPGD P15428 4/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CNR1 P21554 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ CYP1A2 P05177 3/20 0.34
▸ THRB P10828 1/20 0.34
▸ ERBB2 P04626 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ CA12 O43570 2/20 0.32
▸ CA4 P22748 2/20 0.32
▸ CA7 P43166 2/20 0.32
▸ CA9 Q16790 2/20 0.32

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
SCHEMBL29193153 0.76 KDM4E (0.45) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL1952890 0.69 KDM4E (0.52) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL6542121 0.67 ALDH1A1 (0.56) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL17119894 0.67 KMT2A (0.57) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL27927077 0.66 CNR1 (0.52) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL2315443 0.64 MAPT (0.50) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL1952894 0.64 KDM4E (0.46) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL5682827 0.64 ALDH1A1 (0.52) ALDH1A1HPGDHSD17B10KDM4EMAPT
Hydrochloric Acid SCHEMBL27835667 0.63 MAPT (0.49) ALDH1A1HPGDHSD17B10KDM4EMAPT
Pyrene SCHEMBL30114786 0.62 ALDH1A1 (0.73) ALDH1A1HPGDHSD17B10KDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8618298-B2 Perylene tetracarboximide derivatives for photovoltaic devices SOLVAY SA (BE) 2013-12-31 — — US disclosed
US-20110130566-A1 Perylene tetracarboximide derivatives for photovoltaic devices SOLVAY SA (BE) 2011-06-02 — — US disclosed
WO-2010012710-A1 PERYLENE TETRACARBOXIMIDE DERIVATIVES FOR PHOTOVOLTAIC DEVICES SOLVAY SA (BE) 2010-02-04 — — WO 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-20110130566-A1 Perylene tetracarboximide derivatives for photovoltaic devices CDYL, CDY1; CDY1B, ZYX ALDH1A1 3194/4885HPGD 4349/4885HSD17B10 3327/4885

“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.

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