SCHEMBL19322680

SCHEMBL19322680

CCCCCCCCCCCCCCCCOCC(CC(C)C)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 8/20 0.42
PLA2G10 O15496 2/20 0.41
PLA2G2A P14555 2/20 0.41
CETP P11597 3/20 0.40
PLA2G1B P04054 1/20 0.39
PLA2G5 P39877 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL26275584 1.00 TLR2 (0.42) TLR2PLA2G10PLA2G2ACETPPLA2G1B
SCHEMBL17521646 1.00 TLR2 (0.42) TLR2PLA2G10PLA2G2ACETPPLA2G1B
SCHEMBL19958189 1.00 TLR2 (0.42) TLR2PLA2G10PLA2G2ACETPPLA2G1B
SCHEMBL18483905 0.90 TDP1 (0.50) PLA2G10PLA2G2APLA2G1BPLA2G5TDP1
SCHEMBL18484375 0.90 TDP1 (0.50) PLA2G10PLA2G2APLA2G1BPLA2G5TDP1
SCHEMBL18483904 0.90 TDP1 (0.50) PLA2G10PLA2G2APLA2G1BPLA2G5TDP1
SCHEMBL18641859 0.90 PLA2G10 (0.47) TLR2PLA2G10PLA2G2ACETPPLA2G1B
SCHEMBL10604578 0.90 PLA2G10 (0.47) TLR2PLA2G10PLA2G2ACETPPLA2G1B
SCHEMBL10605748 0.90 PLA2G10 (0.47) TLR2PLA2G10PLA2G2ACETPPLA2G1B
SCHEMBL10604671 0.90 PLA2G10 (0.47) TLR2PLA2G10PLA2G2ACETPPLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170253628-A1 PYRROLOPYRIMIDINE NUCLEOSIDES AND ANALOGS THEREOF U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL TRUSTEE 2017-09-07 US 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-20170253628-A1 PYRROLOPYRIMIDINE NUCLEOSIDES AND ANALOGS THEREOF TYMP, PNP, DPYD TLR2 2677/4885PLA2G10 629/4885PLA2G2A 216/4885

“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.