SCHEMBL6502677

SCHEMBL6502677

Cc1cc(COc2cccc(C(=O)O)n2)cc2c1nc(C)n2Cc1ccc(-c2ccccc2)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 5/20 0.40
PTGER1 P34995 2/20 0.39
MRGPRX4 Q96LA9 2/20 0.37
PIK3C2B O00750 2/20 0.37
FFAR1 O14842 1/20 0.37
PDE10A Q9Y233 2/20 0.36
ALOX5AP P20292 1/20 0.36
DCTPP1 Q9H773 1/20 0.35
DHODH Q02127 1/20 0.35

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
SCHEMBL6498704 0.91 P2RX3 (0.45) P2RX3PTGER1MRGPRX4
SCHEMBL6490213 0.86 MRGPRX4 (0.40) MRGPRX4PIK3C2BALOX5APDCTPP1
SCHEMBL6501198 0.85 NR4A2 (0.48) MRGPRX4ALOX5APDHODH
SCHEMBL6493027 0.85 MCL1 (0.43) MRGPRX4PIK3C2BDHODH
SCHEMBL6489174 0.84 PIK3C2B (0.37) P2RX3PIK3C2BALOX5APDCTPP1DHODH
SCHEMBL6488551 0.83 PIK3C2B (0.39) PIK3C2BDHODH
SCHEMBL6487037 0.83 MRGPRX4 (0.46) P2RX3MRGPRX4DCTPP1
SCHEMBL6489503 0.82 CYSLTR1 (0.42) MRGPRX4DCTPP1DHODH
SCHEMBL6488028 0.81 AGTR1 (0.40) MRGPRX4DCTPP1DHODH
SCHEMBL6492577 0.80 DCTPP1 (0.41) PIK3C2BPDE10AALOX5APDCTPP1

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 P2RX3 2660/4885PTGER1 1980/4885MRGPRX4 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.