SCHEMBL6708019

SCHEMBL6708019

O=C(Nc1cccc2cc(C(=O)Nc3ccc(Cl)cc3-c3nnn[nH]3)[nH]c12)c1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 6/20 0.44
PLCG2 P16885 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 2/20 0.40
STK33 Q9BYT3 1/20 0.39
GAA P10253 1/20 0.38
KDR P35968 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
NHERF1 O14745 3/20 0.37
BACE1 P56817 1/20 0.37
PTK2B Q14289 1/20 0.37

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
SCHEMBL6713754 0.93 SERPINE1 (0.43) PLCG2STK33GAAKDRL3MBTL1
SCHEMBL6713465 0.93 GPR35 (0.43) GPR35TDP1
SCHEMBL6710125 0.90 SERPINE1 (0.48) PLCG2MAPTSTK33NHERF1
SCHEMBL6713933 0.90 RXFP1 (0.41) GPR35PLCG2MAPTSTK33L3MBTL1
SCHEMBL6711741 0.89 HIF1A (0.47) GPR35TDP1MAPTSTK33
SCHEMBL6710112 0.89 MAP3K5 (0.45) PLCG2TDP1MAPTSTK33NHERF1
SCHEMBL6708855 0.89 KDR (0.45) PLCG2MAPTSTK33GAAKDR
SCHEMBL6711906 0.88 NHERF1 (0.46) PLCG2STK33GAANHERF1
SCHEMBL6711731 0.87 KDR (0.43) GPR35TDP1MAPTKDR
SCHEMBL6714040 0.87 F10 (0.38) GPR35PLCG2TDP1MAPTSTK33

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 GPR35 2928/4885PLCG2 4289/4885TDP1 2977/4885

“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.