SCHEMBL6707909

SCHEMBL6707909

O=C(Nc1ccc(Br)cc1-c1nnn[nH]1)c1cc2cccc(Cl)c2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 1/20 0.41
GPR35 Q9HC97 7/20 0.41
RXFP1 Q9HBX9 2/20 0.38
HIF1A Q16665 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TP53 P04637 2/20 0.37
POLB P06746 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 2/20 0.37
HRH4 Q9H3N8 1/20 0.36
PLCG2 P16885 1/20 0.36
NSD2 O96028 1/20 0.36
PYGL P06737 1/20 0.35
PYGM P11217 1/20 0.35
CYP1A2 P05177 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL6711816 0.90 PLCG2 (0.44) MAP3K5RXFP1TP53POLBLMNA
SCHEMBL6709089 0.89 RXFP1 (0.38) GPR35RXFP1HIF1ANPSR1TP53
SCHEMBL6713465 0.89 GPR35 (0.43) GPR35RXFP1HIF1ANPSR1
SCHEMBL6707722 0.89 NSD2 (0.50) GPR35RXFP1HIF1ANPSR1POLB
SCHEMBL6707817 0.88 GPR35 (0.35) MAP3K5GPR35RXFP1HIF1ANPSR1
SCHEMBL6707953 0.87 MAP3K5 (0.45) MAP3K5GPR35RXFP1HIF1ANPSR1
SCHEMBL6711741 0.87 HIF1A (0.47) GPR35RXFP1HIF1ANPSR1TP53
SCHEMBL6714324 0.87 PARP14 (0.42) GPR35MAPT
SCHEMBL6711486 0.86 NPC1 (0.42) RXFP1HIF1ANPSR1LMNA
SCHEMBL6712039 0.86 MAP3K5 (0.40) MAP3K5RXFP1TP53POLBLMNA

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 MAP3K5 3051/4885GPR35 2928/4885RXFP1 3836/4885

“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.