SCHEMBL6709968

SCHEMBL6709968

Cc1ccccc1-c1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3nnn[nH]3)n(C)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
GRM4 Q14833 1/20 0.38
ROCK1 Q13464 3/20 0.37
RXFP1 Q9HBX9 2/20 0.37
S1PR4 O95977 1/20 0.35
POLB P06746 2/20 0.34
MAPT P10636 3/20 0.34
TP53 P04637 2/20 0.34
CNR1 P21554 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
NPY1R P25929 1/20 0.34
HTT P42858 1/20 0.34
NPY2R P49146 1/20 0.34
RAB9A P51151 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KCNMA1 Q12791 1/20 0.33
STK33 Q9BYT3 1/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL6711863 0.91 GRM4 (0.37) LMNAGRM4ROCK1RXFP1MAPT
SCHEMBL6710144 0.90 ROCK1 (0.39) LMNAGRM4ROCK1RXFP1KDM4E
SCHEMBL6710507 0.90 HIF1A (0.42) LMNAGRM4RXFP1POLBMAPT
SCHEMBL6711785 0.89 HPGD (0.40) GRM4ROCK1POLBMAPTKDM4E
SCHEMBL6711396 0.88 HSD11B1 (0.38) GRM4ROCK1RXFP1MAPTTP53
SCHEMBL6708796 0.88 RXFP1 (0.39) LMNAGRM4ROCK1RXFP1POLB
SCHEMBL6710080 0.87 RXFP1 (0.35) LMNAGRM4ROCK1RXFP1MAPT
SCHEMBL6708989 0.87 LMNA (0.38) LMNAGRM4POLBMAPTTP53
SCHEMBL6712526 0.87 RXFP1 (0.39) LMNAGRM4ROCK1RXFP1TP53
SCHEMBL6714173 0.86 GRM4 (0.47) LMNAGRM4ROCK1RXFP1MAPT

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 LMNA 4062/4885GRM4 4668/4885ROCK1 4830/4885

“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.