SCHEMBL6503536

SCHEMBL6503536

Cc1cc(OCCCC(=O)O)cc2c1nc(C)n2Cc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 8/20 0.46
PLA2G2A P14555 3/20 0.44
PIK3C2B O00750 2/20 0.42
PPARG P37231 1/20 0.42
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
DCTPP1 Q9H773 1/20 0.41

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
SCHEMBL6488044 0.92 PIK3C2B (0.51) MCL1PLA2G2APIK3C2BDCTPP1
SCHEMBL6489813 0.90 MCL1 (0.43) MCL1PLA2G2APPARGFFAR1FFAR4
SCHEMBL6489154 0.90 ALDH1A1 (0.47) MCL1PLA2G2APPARGDCTPP1
SCHEMBL6490634 0.89 MCL1 (0.46) MCL1PLA2G2APPARGFFAR4
SCHEMBL6501595 0.89 MCL1 (0.46) MCL1PLA2G2AFFAR1FFAR4DCTPP1
SCHEMBL6502699 0.88 MCL1 (0.46) MCL1PLA2G2AFFAR4DCTPP1
SCHEMBL6489649 0.87 MCL1 (0.44) MCL1PLA2G2APIK3C2BPPARGFFAR4
SCHEMBL6501386 0.87 MCL1 (0.48) MCL1PLA2G2AFFAR1FFAR4DCTPP1
SCHEMBL6488344 0.86 MCL1 (0.47) MCL1PLA2G2APPARGFFAR1FFAR4
SCHEMBL6501119 0.86 MCL1 (0.43) MCL1PLA2G2AFFAR4DCTPP1

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 806/4885PLA2G2A 4801/4885PIK3C2B 2433/4885

“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.