SCHEMBL5075432

SCHEMBL5075432

CCCCCCCCCCCCC(CCCCCCCCCC)CC(=O)OCCCC

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.55
TLR4 O00206 1/20 0.51
DGKA P23743 1/20 0.50
NPSR1 Q6W5P4 2/20 0.47
RAD52 P43351 1/20 0.47
ATM Q13315 1/20 0.47
FAAH O00519 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
HTR2C P28335 1/20 0.45
ZDHHC7 Q9NXF8 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HCAR2 Q8TDS4 1/20 0.43
GPR84 Q9NQS5 2/20 0.43
EPHX1 P07099 1/20 0.43

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
SCHEMBL5075443 1.00 NAAA (0.55) NAAATLR4DGKANPSR1RAD52
SCHEMBL5075966 1.00 NAAA (0.55) NAAATLR4DGKANPSR1RAD52
SCHEMBL5079146 1.00 NAAA (0.55) NAAATLR4DGKANPSR1RAD52
SCHEMBL23223349 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52
SCHEMBL11088770 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52
SCHEMBL23223504 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52
SCHEMBL11088534 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52
SCHEMBL25125462 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52
SCHEMBL23223362 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52
SCHEMBL16845004 0.96 NAAA (0.60) NAAATLR4DGKANPSR1RAD52

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-7402610-B2 Carbonyl compound containing long-chain branched alkyl group IDEMITSU KOSAN CO., LTD. (JP) 2008-07-22 US disclosed
US-20070282123-A1 Carbonyl Compound Containing Long-Chain Branched Alkyl Group IDEMITSU KOSAN CO., LTD (JP) 2007-12-06 US disclosed
EP-1710225-A1 CARBONYL COMPOUND CONTAINING LONG-CHAIN BRANCHED ALKYL GROUP IDEMITSU KOSAN CO., LTD. (JP) 2006-10-11 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-20070282123-A1 Carbonyl Compound Containing Long-Chain Branched Alkyl Group HSD17B12, ALOX15, LSS NAAA 2358/4885TLR4 861/4885DGKA 1803/4885

“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.