SCHEMBL6491237

SCHEMBL6491237

CCOc1ccc(Cn2c(C)nc3ccc(OCCCC(=O)O)cc32)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.49
FFAR4 Q5NUL3 2/20 0.49
PPARG P37231 1/20 0.45
PDE3B Q13370 5/20 0.44
PDE3A Q14432 5/20 0.44
P2RY12 Q9H244 3/20 0.44
MCL1 Q07820 1/20 0.43
PDE2A O00408 3/20 0.43
PLA2G2A P14555 4/20 0.42
MAPT P10636 1/20 0.42
ALOX5AP P20292 2/20 0.41
ACSS2 Q9NR19 1/20 0.40
DCTPP1 Q9H773 1/20 0.40

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
SCHEMBL6492145 0.93 PPARG (0.51) FFAR1FFAR4PPARGPDE3BPDE3A
SCHEMBL6498632 0.91 PDE3B (0.48) FFAR1FFAR4PPARGPDE3BPDE3A
SCHEMBL6491422 0.91 PPARG (0.51) PPARGPDE3BPDE3AP2RY12MCL1
SCHEMBL6501536 0.91 PPARG (0.52) FFAR1FFAR4PPARGPDE3BPDE3A
SCHEMBL6500098 0.91 PPARG (0.50) PPARGPDE3BPDE3AP2RY12MCL1
SCHEMBL6498744 0.90 PPARG (0.51) PPARGPDE3BPDE3AP2RY12MCL1
SCHEMBL6501386 0.88 MCL1 (0.48) FFAR1FFAR4PDE3BPDE3AP2RY12
SCHEMBL6491416 0.87 PPARG (0.41) FFAR1FFAR4PPARGPDE3BPDE3A
SCHEMBL6926026 0.86 ALDH1A1 (0.44) FFAR1FFAR4PPARGPDE3BPDE3A
SCHEMBL6497461 0.86 PPARG (0.49) PPARGPDE3BPDE3AP2RY12MCL1

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-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD FFAR1 1226/4885FFAR4 960/4885PPARG 233/4885

“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.