SCHEMBL6487607

SCHEMBL6487607

CCOc1cnc(Cn2c(C)nc3c(C)cc(OCc4cccc(C)c4C(=O)O)cc32)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
REN P00797 1/20 0.38
PIK3C2B O00750 3/20 0.37
BCL2 P10415 5/20 0.35
MCL1 Q07820 5/20 0.35
PPARG P37231 2/20 0.34
ALOX5AP P20292 2/20 0.34
SLC22A12 Q96S37 1/20 0.34
DCTPP1 Q9H773 2/20 0.34
SLC16A3 O15427 2/20 0.34
SLC16A1 P53985 2/20 0.34
PIK3CB P42338 2/20 0.33
MCTS1 Q9ULC4 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
SCHEMBL6495279 0.93 MAPT (0.36) RENPIK3C2BALOX5APDCTPP1SLC16A3
SCHEMBL6501064 0.91 PIK3C2B (0.38) PIK3C2BBCL2MCL1PPARGDCTPP1
SCHEMBL6490992 0.90 BCL2 (0.45) PIK3C2BBCL2MCL1
SCHEMBL6491725 0.90 PIK3C2B (0.37) PIK3C2BBCL2MCL1ALOX5APSLC22A12
SCHEMBL6503787 0.88 PIK3C2B (0.38) PIK3C2BBCL2MCL1PPARGALOX5AP
SCHEMBL6489176 0.85 BCL2 (0.38) BCL2MCL1DCTPP1
SCHEMBL6492258 0.85 ALDH1A1 (0.35) PIK3C2BPPARGDCTPP1
SCHEMBL6492991 0.82 DCTPP1 (0.36) PIK3C2BBCL2MCL1DCTPP1
SCHEMBL6489538 0.81 MCL1 (0.42) MCL1
SCHEMBL6491005 0.81 BCL2 (0.47) PIK3C2BBCL2MCL1

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 REN 331/4885PIK3C2B 2433/4885BCL2 774/4885

“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.