SCHEMBL6711640

SCHEMBL6711640

Cn1c(C(=O)Nc2ccc(Br)cc2-c2nnn[nH]2)cc2ccc(NS(=O)(=O)c3cccc4cccnc34)cc21

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.45
KMT2A Q03164 8/20 0.45
BRD4 O60885 2/20 0.43
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 3/20 0.41
GAA P10253 1/20 0.41
NTSR1 P30989 2/20 0.39
F2 P00734 1/20 0.39
HDAC1 Q13547 1/20 0.38
HTR6 P50406 1/20 0.38
HPGD P15428 1/20 0.38
GRM4 Q14833 1/20 0.38
ATM Q13315 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
SCHEMBL6708876 0.92 MEN1 (0.45) MEN1KMT2ABRD4MAPTNPSR1
SCHEMBL6710299 0.90 BRD4 (0.42) MEN1KMT2ABRD4MAPTNPSR1
SCHEMBL6711838 0.86 MEN1 (0.43) MEN1KMT2ABRD4MAPTNPSR1
SCHEMBL6713418 0.86 RXFP1 (0.36) NPSR1ALDH1A1GRM4ATM
SCHEMBL6713231 0.80 GRM4 (0.39) MAPTNPSR1HDAC1GRM4
SCHEMBL6711229 0.80 MAPT (0.45) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL6709025 0.79 GRM4 (0.46) MEN1KMT2ANPSR1HDAC1GRM4
SCHEMBL6708827 0.79 GAA (0.44) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL6711388 0.79 MEN1 (0.44) MEN1KMT2ABRD4MAPTNPSR1
SCHEMBL6710017 0.77 RXFP1 (0.45) ALDH1A1GRM4ATM

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 MEN1 4100/4885KMT2A 3181/4885BRD4 1588/4885

“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.