SCHEMBL6503445

SCHEMBL6503445

CCSc1nc2c(C)cc(OCc3ccccc3C(=O)O)cc2n1Cc1ccc(-c2ccccc2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.46
BCL2 P10415 7/20 0.43
MCL1 Q07820 7/20 0.43
ALOX5AP P20292 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PTGER1 P34995 1/20 0.38

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
SCHEMBL6488074 0.93 AGTR1 (0.43) AGTR1BCL2MCL1ALOX5APPTGER1
SCHEMBL6501134 0.89 BCL2 (0.47) BCL2MCL1MRGPRX4
SCHEMBL6500043 0.88 BCL2 (0.45) AGTR1BCL2MCL1
SCHEMBL6500822 0.87 AGTR1 (0.47) AGTR1BCL2MCL1
SCHEMBL6492366 0.85 PIK3C2B (0.45) BCL2MCL1ALOX5APMRGPRX4
SCHEMBL6501228 0.84 BCL2 (0.40) AGTR1BCL2MCL1ALOX5APMRGPRX4
SCHEMBL6500552 0.83 MRGPRX4 (0.49) BCL2MCL1ALOX5APMRGPRX4PTGER1
SCHEMBL6502827 0.83 ALOX5AP (0.41) AGTR1BCL2MCL1ALOX5APMRGPRX4
SCHEMBL6498787 0.82 BCL2 (0.40) AGTR1BCL2MCL1ALOX5AP
SCHEMBL6488562 0.81 AGTR1 (0.41) AGTR1BCL2MCL1

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 AGTR1 2045/4885BCL2 774/4885MCL1 806/4885

“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.