SCHEMBL6500949

SCHEMBL6500949

CCCCCOc1ccc(Cn2c(C)nc3c(C)cc(OCc4cccc(C(=O)O)c4)cc32)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 4/20 0.54
MCL1 Q07820 4/20 0.54
MRGPRX4 Q96LA9 12/20 0.52
PLA2G4B P0C869 1/20 0.46
PLA2G2A P14555 1/20 0.43
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL6489570 0.93 BCL2 (0.46) BCL2MCL1MRGPRX4PLA2G4BPLA2G2A
SCHEMBL6502208 0.88 MCL1 (0.44) BCL2MCL1MRGPRX4
SCHEMBL6496934 0.87 MCL1 (0.54) BCL2MCL1PLA2G2A
SCHEMBL7194322 0.87 BCL2 (0.48) BCL2MCL1MRGPRX4PLA2G2A
SCHEMBL6497730 0.87 PPARG (0.44) MCL1PLA2G4BPLA2G2ATP53
SCHEMBL6497678 0.86 PTPN11 (0.46) PLA2G4B
SCHEMBL6488344 0.85 MCL1 (0.47) MCL1PLA2G4BPLA2G2A
SCHEMBL6489346 0.84 MRGPRX4 (0.46) MRGPRX4TP53PKMNFKB1NFKB2
SCHEMBL6501700 0.84 MCL1 (0.40) BCL2MCL1
SCHEMBL6500130 0.83 DCTPP1 (0.47) BCL2MCL1SMN1; SMN2

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 BCL2 774/4885MCL1 806/4885MRGPRX4 2443/4885

“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.