SCHEMBL4585925

SCHEMBL4585925

CCCc1ccsc1-c1cccs1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.38
ADORA2A P29274 3/20 0.37
ADORA1 P30542 3/20 0.37
SREBF2 Q12772 1/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
DPP4 P27487 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 3/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
USP2 O75604 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35

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
SCHEMBL1224308 0.89 ADK (0.43) LTA4HADORA2AADORA1MEN1KMT2A
SCHEMBL4585059 0.88 ADK (0.40) LTA4HADORA2AADORA1MEN1KMT2A
SCHEMBL1224490 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL6419558 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL4584611 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL723466 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL4585311 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL4585770 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL4584258 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL28093504 0.86 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8334391-B2 Functionalized heteroacenes XEROX CORPORATION (US) 2012-12-18 US claimed
US-7372071-B2 Functionalized heteroacenes and electronic devices generated therefrom XEROX CORPORATION (US) 2008-05-13 US claimed
US-20070260069-A1 Functionalized heteroacenes XEROX CORPORATION 2007-11-08 US claimed
US-20070235721-A1 Functionalized heteroacenes and electronic devices generated therefrom XEROX CORPORATION 2007-10-11 US claimed
WO-2014128277-A1 PHOTOACTIVE, ORGANIC MATERIAL FOR OPTOELECTRONIC COMPONENTS HELIATEK (DE) 2014-08-28 WO disclosed
EP-1843410-B1 Functionalized heteroacenes and electronic devices generated therefrom XEROX CORP (US) 2013-10-16 EP disclosed
EP-1843410-A2 Functionalized heteroacenes and electronic devices generated therefrom Xerox Corporation (US) 2007-10-10 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-20070260069-A1 Functionalized heteroacenes SOD1, AHR, NR0B2 LTA4H 3381/4885ADORA2A 2322/4885ADORA1 2934/4885

“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.