SCHEMBL6710167

SCHEMBL6710167

N#Cc1ccc(NC(=O)c2noc3cc(O)ccc23)c(-c2nnn[nH]2)c1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.38
ESR2 Q92731 6/20 0.38
HIF1A Q16665 10/20 0.34
HSP90AA1 P07900 1/20 0.32
TNIK Q9UKE5 1/20 0.31
LRRK2 Q5S007 1/20 0.31
ROCK1 Q13464 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL6710001 0.90 HIF1A (0.34) HIF1ALRRK2
SCHEMBL6707637 0.90 HIF1A (0.39) HIF1ACYP1A2
SCHEMBL6709888 0.89 HIF1A (0.47) HIF1AROCK1
SCHEMBL6710321 0.88 MAPT (0.42) HIF1ALRRK2CYP1A2
SCHEMBL6708765 0.88 HIF1A (0.43) HIF1ALRRK2ROCK1
SCHEMBL6710174 0.87 HIF1A (0.36) ESR1ESR2HIF1AHSP90AA1LMNA
SCHEMBL6710147 0.86 TP53 (0.34) HIF1ALRRK2LMNACYP1A2
SCHEMBL6707842 0.86 HIF1A (0.43) ESR1ESR2HIF1AHSP90AA1ROCK1
SCHEMBL6711786 0.86 TNIK (0.38) HIF1ATNIKLRRK2
SCHEMBL6709290 0.85 GPR35 (0.34) HIF1ALRRK2LMNA

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 ESR1 237/4885ESR2 1251/4885HIF1A 296/4885

“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.