SCHEMBL6489324

SCHEMBL6489324

COc1cc(-c2ccccc2)ccc1Cn1c(C)nc2c(C)cc(OCc3ccccc3C(=O)O)cc21

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 7/20 0.42
MCL1 Q07820 7/20 0.42
AGTR1 P30556 4/20 0.42
AGTR2 P50052 4/20 0.42
PIK3C2B O00750 2/20 0.40
PPARD Q03181 2/20 0.38
PLA2G2A P14555 1/20 0.38
FABP4 P15090 1/20 0.38
PTGER4 P35408 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
SCHEMBL6498621 0.93 AGTR1 (0.40) BCL2MCL1AGTR1AGTR2PPARD
SCHEMBL6501134 0.89 BCL2 (0.47) BCL2MCL1PIK3C2BPLA2G2A
SCHEMBL6491216 0.84 FFAR4 (0.43) MCL1PPARDPLA2G2A
SCHEMBL6498787 0.83 BCL2 (0.40) BCL2MCL1AGTR1AGTR2PIK3C2B
SCHEMBL6487617 0.83 BCL2 (0.46) BCL2MCL1AGTR1AGTR2PIK3C2B
SCHEMBL6501228 0.82 BCL2 (0.40) BCL2MCL1AGTR1AGTR2PIK3C2B
SCHEMBL6500552 0.82 MRGPRX4 (0.49) BCL2MCL1PIK3C2BPLA2G2AFABP4
SCHEMBL6489585 0.82 BCL2 (0.48) BCL2MCL1PIK3C2BPLA2G2A
SCHEMBL6498255 0.82 FAAH (0.41) AGTR1AGTR2PPARDPLA2G2A
SCHEMBL6502827 0.82 ALOX5AP (0.41) BCL2MCL1AGTR1AGTR2PIK3C2B

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 806/4885AGTR1 2045/4885

“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.