SCHEMBL6489346

SCHEMBL6489346

CCOc1ccc(Cn2c(C)nc3c(C)cc(COc4cccc(C(=O)O)c4)cc32)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.46
NR4A2 P43354 5/20 0.46
NR4A1 P22736 1/20 0.46
NR4A3 Q92570 1/20 0.46
TP53 P04637 1/20 0.45
PKM P14618 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PPARG P37231 8/20 0.45
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
NR1H4 Q96RI1 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
SCHEMBL6490528 0.92 DCTPP1 (0.42) MRGPRX4SMN1; SMN2PPARGNR1H4
SCHEMBL6501562 0.92 NR4A2 (0.57) MRGPRX4NR4A2NR4A1NR4A3PPARG
SCHEMBL6501198 0.89 NR4A2 (0.48) MRGPRX4NR4A2NR4A1NR4A3PPARG
SCHEMBL7196400 0.87 PIK3C2B (0.40) MRGPRX4PPARG
SCHEMBL6488966 0.86 RXRA (0.41) MRGPRX4NR4A2NR4A1NR4A3TP53
SCHEMBL7200216 0.86 PIK3C2B (0.41) MRGPRX4SMN1; SMN2NPC1RAB9A
SCHEMBL6498814 0.86 S1PR1 (0.39) PPARG
SCHEMBL6500949 0.84 BCL2 (0.54) MRGPRX4TP53PKMNFKB1NFKB2
SCHEMBL6489915 0.83 NR4A2 (0.46) MRGPRX4NR4A2NR4A1NR4A3SMN1; SMN2
SCHEMBL6501593 0.82 KDM4C (0.44)

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 2 patents. 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
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO 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 MRGPRX4 2443/4885NR4A2 2264/4885NR4A1 1583/4885

“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.