SCHEMBL6712466

SCHEMBL6712466

CC(=O)OCC(=O)Nc1cccc2cc(C(=O)Nc3ccc(Br)cc3-c3nnn[nH]3)[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 9/20 0.39
POLB P06746 2/20 0.36
TP53 P04637 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
MAP3K5 Q99683 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
USP2 O75604 1/20 0.34
HPGD P15428 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL6920531 0.96 NPSR1 (0.41) GPR35POLBTP53MAPTLMNA
SCHEMBL6711411 0.92 GPR35 (0.42) GPR35POLBTP53MAPTLMNA
SCHEMBL6710241 0.89 GPR35 (0.43) GPR35POLBTP53MAPTLMNA
SCHEMBL6707737 0.89 GPR35 (0.40) GPR35POLBTP53MAPTLMNA
SCHEMBL6709867 0.88 GPR35 (0.39) GPR35POLBTP53MAPTLMNA
SCHEMBL6708802 0.88 POLB (0.35) POLBTP53MAPTLMNAMAP3K5
SCHEMBL6707953 0.88 MAP3K5 (0.45) GPR35POLBTP53MAPTLMNA
SCHEMBL6710114 0.88 KMT2A (0.42) GPR35POLBTP53MAPTLMNA
SCHEMBL6708714 0.88 POLB (0.41) GPR35POLBTP53MAPTLMNA
SCHEMBL6712420 0.88 PARP14 (0.38) GPR35POLBTP53MAPTLMNA

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 GPR35 2928/4885POLB 626/4885TP53 2699/4885

“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.