SCHEMBL6502076

SCHEMBL6502076

CCCCCOc1ccc(Cn2c(C)nc3cccc(OCCCC(=O)OCC)c32)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 3/20 0.45
CYSLTR1 Q9Y271 3/20 0.45
FAAH O00519 2/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
P2RY12 Q9H244 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PLA2G2A P14555 3/20 0.39
BRD4 O60885 1/20 0.39
P2RX3 P56373 1/20 0.38
DHFR P00374 1/20 0.38
EPHX2 P34913 1/20 0.38
MMP13 P45452 1/20 0.38
PPARG P37231 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL6492358 0.97 CYSLTR2 (0.43) CYSLTR2CYSLTR1FAAHPDE3BPDE3A
SCHEMBL6491561 0.92 PLA2G4B (0.40) CYSLTR2CYSLTR1PLA2G2APPARGTHRA
SCHEMBL6489614 0.89 PLA2G4B (0.41) CYSLTR2CYSLTR1PPARGTHRATHRB
SCHEMBL6489555 0.88 PLA2G4B (0.45) CYSLTR2PLA2G2APPARGALOX5AP
SCHEMBL6490815 0.87 CYSLTR2 (0.41) CYSLTR2CYSLTR1FAAHPDE3BPDE3A
SCHEMBL6497754 0.85 PDE3B (0.44) CYSLTR2CYSLTR1PDE3BPDE3AP2RY12
SCHEMBL6497461 0.85 PPARG (0.49) CYSLTR2CYSLTR1PDE3BPDE3AP2RY12
SCHEMBL6925454 0.85 PSEN1 (0.41) KDM4EALDH1A1PLA2G2APPARGALOX5AP
SCHEMBL7194187 0.85 PPARG (0.40) KDM4EPLA2G2APPARGALOX5APTHRB
SCHEMBL7200184 0.85 PPARG (0.39) KDM4EPLA2G2APPARGALOX5APTHRB

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-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD CYSLTR2 2679/4885CYSLTR1 2525/4885FAAH 4636/4885

“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.