SCHEMBL6489538

SCHEMBL6489538

CCOc1cnc(Cn2c(C)nc3c(C)cc(OCCCC(=O)O)cc32)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 10/20 0.42
FFAR4 Q5NUL3 3/20 0.40
FFAR1 O14842 2/20 0.40
PLA2G2A P14555 3/20 0.36
PDE4B Q07343 1/20 0.36
PDE4D Q08499 1/20 0.36
BCL2L1 Q07817 1/20 0.35
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL6490678 0.94 MCL1 (0.41) MCL1FFAR4PLA2G2ABCL2L1
SCHEMBL6489292 0.92 MCL1 (0.38) MCL1PLA2G2AALDH1A1MAPTHPGD
SCHEMBL6491201 0.90 MCL1 (0.43) MCL1FFAR4PLA2G2ABCL2L1ALDH1A1
SCHEMBL6500004 0.87 CYSLTR2 (0.37) MCL1PLA2G2A
SCHEMBL7195341 0.86 DCTPP1 (0.31) MCL1
SCHEMBL6497809 0.86 MCL1 (0.41) MCL1FFAR4FFAR1ALDH1A1MAPT
SCHEMBL6501386 0.85 MCL1 (0.48) MCL1FFAR4FFAR1PLA2G2A
SCHEMBL7195347 0.85 GCG (0.32) PDE4BPDE4D
SCHEMBL6502360 0.84 PABPC1 (0.39) MCL1PLA2G2AALDH1A1
SCHEMBL6488122 0.81 MCL1 (0.46) MCL1FFAR4FFAR1PLA2G2A

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 MCL1 806/4885FFAR4 960/4885FFAR1 1226/4885

“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.