SCHEMBL6711696

SCHEMBL6711696

CC1(C(=O)Nc2cccc3cc(C(=O)Nc4ccc(Br)cc4-c4noc(=O)[nH]4)[nH]c23)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
RARA P10276 1/20 0.37
NSD2 O96028 1/20 0.35
ADORA1 P30542 1/20 0.34
TP53 P04637 3/20 0.34
POLB P06746 3/20 0.33
MAP3K5 Q99683 1/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
NR2E3 Q9Y5X4 1/20 0.33
BTK Q06187 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
SCHEMBL6710492 0.90 GRIK1 (0.41) GRIK1RARANSD2TP53POLB
SCHEMBL6708757 0.88 GRIK1 (0.42) GRIK1NSD2TP53POLBMAP3K5
SCHEMBL6709020 0.88 RARA (0.35) RARANSD2TP53POLBMAP3K5
SCHEMBL6708679 0.88 GRIK1 (0.44) GRIK1NSD2TP53POLBMAPT
SCHEMBL6707656 0.87 SMN1; SMN2 (0.46) GRIK1POLBLMNA
SCHEMBL6713707 0.86 MEN1 (0.38) GRIK1TP53LMNA
SCHEMBL6713760 0.86 GRIK1 (0.42) GRIK1NSD2TP53MAPT
SCHEMBL6713262 0.86 GRIK1 (0.41) GRIK1NSD2TP53POLBLMNA
SCHEMBL6710166 0.85 NPC1 (0.43) GRIK1LMNA
SCHEMBL6713911 0.85 GRIK1 (0.40) GRIK1NSD2TP53POLBMAPT

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 2 patents. 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
WO-2004018461-A2 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO 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 GRIK1 3885/4885RARA 182/4885NSD2 3824/4885

“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.