SCHEMBL2176969

SCHEMBL2176969

CCCCCCCCc1ccsc1/C=C/c1sccc1CCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.43
MAPT P10636 2/20 0.43
ALOX15 P16050 2/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX5 P09917 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
LIPG Q9Y5X9 1/20 0.41
BID P55957 3/20 0.38
MCL1 Q07820 3/20 0.38
BCL2L1 Q07817 2/20 0.38
BAK1 Q16611 2/20 0.38
KAT8 Q9H7Z6 2/20 0.38
SAE1 Q9UBE0 2/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL2492584 1.00 TYR (0.43) TYRMAPTALOX15MEN1TP53
SCHEMBL2176976 1.00 TYR (0.43) TYRMAPTALOX15MEN1TP53
SCHEMBL12159726 1.00 TYR (0.43) TYRMAPTALOX15MEN1TP53
SCHEMBL30613895 1.00 TYR (0.43) TYRMAPTALOX15MEN1TP53
SCHEMBL2492582 1.00 TYR (0.43) TYRMAPTALOX15MEN1TP53
SCHEMBL12339009 0.93 TYR (0.39) TYRMAPTALOX15MEN1TP53
SCHEMBL12339026 0.92 TYR (0.40) TYRMAPTALOX15MEN1TP53
SCHEMBL13410333 0.89 MEN1 (0.36) TYRMAPTALOX15MEN1TP53
SCHEMBL10301447 0.86 HIF1A (0.42) TYRMAPTALOX15MEN1TP53
SCHEMBL5146971 0.86 TYR (0.41) TYRMAPTALOX15MEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8269099-B2 Electron donating organic material for photovoltaic devices, material for photovoltaic devices, and photovoltaic device TORAY INDUSTRIES, INC. (JP) 2012-09-18 US disclosed
US-8269099-B2 Electron donating organic material for photovoltaic devices, material for photovoltaic devices, and photovoltaic device TORAY INDUSTRIES, INC. (JP) 2012-09-18 US disclosed
US-7973074-B2 π-conjugated mono-, oligo- and polymeric compounds, and photovoltaic cells comprising them COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2011-07-05 US disclosed
US-20100006154-A1 ELECTRON DONATING ORGANIC MATERIAL FOR PHOTOVOLTAIC DEVICES, MATERIAL FOR PHOTOVOLTAIC DEVICES, AND PHOTOVOLTAIC DEVICE TORAY INDUSTRIES, INC. (JP) 2010-01-14 US disclosed
US-20100006154-A1 ELECTRON DONATING ORGANIC MATERIAL FOR PHOTOVOLTAIC DEVICES, MATERIAL FOR PHOTOVOLTAIC DEVICES, AND PHOTOVOLTAIC DEVICE TORAY INDUSTRIES, INC. (JP) 2010-01-14 US disclosed
EP-1756193-B1 MONOMER, OLIGOMER AND PI-CONJUGATED POLYMER COMPOUNDS, AND PHOTOVOLTAIC CELLS CONTAINING SAME COMMISSARIAT ENERGIE ATOMIQUE (FR) 2009-11-11 EP disclosed
US-20070289625-A1 -Conjugated Mono-, Oligo-and Polymeric Compounds, and Photovoltaic Cells Comprising Them COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2007-12-20 US disclosed
EP-1756193-A1 MONOMER, OLIGOMER AND PI-CONJUGATED POLYMER COMPOUNDS, AND PHOTOVOLTAIC CELLS CONTAINING SAME COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2007-02-28 EP disclosed
WO-2005105884-A1 MONOMER, OLIGOMER AND PI-CONJUGATED POLYMER COMPOUNDS, AND PHOTOVOLTAIC CELLS CONTAINING SAME COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2005-11-10 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-20070289625-A1 -Conjugated Mono-, Oligo-and Polymeric Compounds, and Photovoltaic Cells Comprising Them XPA, EPCAM, CD4 TYR 17/4885MAPT 1901/4885ALOX15 2666/4885

“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.