SCHEMBL6713660

SCHEMBL6713660

Cc1ccccc1-c1ccc2cc(C(=O)Nc3ccc(Cl)cc3-c3noc(=O)[nH]3)n(C)c2c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 4/20 0.44
RXFP1 Q9HBX9 1/20 0.41
GRM4 Q14833 1/20 0.39
LMNA P02545 1/20 0.39
GRIK1 P39086 1/20 0.39
F11 P03951 1/20 0.39
KLKB1 P03952 1/20 0.39
FTO Q9C0B1 1/20 0.38
CNR1 P21554 1/20 0.38
F10 P00742 3/20 0.36
LCK P06239 1/20 0.36
PPARG P37231 1/20 0.36
CCKBR P32239 2/20 0.36
F2 P00734 1/20 0.35
KLK1 P06870 1/20 0.35
ROCK2 O75116 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
SCHEMBL6713081 0.91 ROCK1 (0.43) ROCK1RXFP1GRM4GRIK1F11
SCHEMBL6708878 0.90 ROCK1 (0.40) ROCK1RXFP1GRM4LMNAGRIK1
SCHEMBL6711766 0.89 ROCK1 (0.42) ROCK1RXFP1GRM4GRIK1F11
SCHEMBL6708877 0.88 ROCK1 (0.38) ROCK1LMNAF11KLKB1LCK
SCHEMBL6710298 0.87 GRM4 (0.51) ROCK1RXFP1GRM4LMNAGRIK1
SCHEMBL6707969 0.86 FTO (0.46) ROCK1RXFP1GRM4GRIK1F11
SCHEMBL6710342 0.85 GRIK1 (0.42) ROCK1RXFP1GRM4LMNAGRIK1
SCHEMBL6713555 0.84 RXFP1 (0.46) ROCK1RXFP1GRM4GRIK1F11
SCHEMBL6713698 0.84 CPT1A (0.40) ROCK1RXFP1GRIK1F11KLKB1
SCHEMBL6711840 0.84 ROCK1 (0.43) ROCK1RXFP1GRM4LMNACNR1

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 ROCK1 4830/4885RXFP1 3836/4885GRM4 4668/4885

“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.