SCHEMBL1611041

SCHEMBL1611041

[CH2]C(CCCCCC)c1cccc2cc3ccccc3cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 2/20 0.34
MEN1 O00255 2/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
CYP2C19 P33261 1/20 0.34
HIF1A Q16665 1/20 0.34
GMNN O75496 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL1610202 0.98 PPARG (0.35) PPARGPPARAMAPTKMT2AKDM4E
SCHEMBL1612446 0.94 MEN1 (0.35) PPARGPPARAMAPTKMT2AKDM4E
SCHEMBL1611322 0.88 PPARG (0.35) PPARGPPARAMAPTKMT2AKDM4E
SCHEMBL23174666 0.86 KDM4E (0.44) KMT2AKDM4EL3MBTL1MAPK1MEN1
SCHEMBL28188133 0.86 KDM4E (0.44) KMT2AKDM4EL3MBTL1MAPK1MEN1
SCHEMBL28188783 0.86 KDM4E (0.44) KMT2AKDM4EL3MBTL1MAPK1MEN1
SCHEMBL1610343 0.86 KDM4E (0.44) KMT2AKDM4EL3MBTL1MAPK1MEN1
SCHEMBL27654860 0.86 KDM4E (0.44) KMT2AKDM4EL3MBTL1MAPK1MEN1
SCHEMBL27715914 0.85 CYSLTR2 (0.42) PPARGPPARAMAPTKMT2AKDM4E
SCHEMBL1610469 0.84 ALDH1A1 (0.43) KMT2AKDM4EL3MBTL1CYP1A2CYP2C9

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-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 PPARG 3986/4885PPARA 3635/4885MAPT 3838/4885

“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.