SCHEMBL6709906

SCHEMBL6709906

N#Cc1ccc(NC(=O)c2cc3cccc(NC(=O)C4CCC4)c3[nH]2)c(-c2noc(=O)[nH]2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.37
ABL1 P00519 1/20 0.34
KDM4E B2RXH2 3/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP1A2 P05177 1/20 0.34
MAOB P27338 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PLA2G7 Q13093 1/20 0.33
USP30 Q70CQ3 1/20 0.33
RORC P51449 1/20 0.32
PARP14 Q460N5 1/20 0.32
NSD2 O96028 1/20 0.32
GSK3A P49840 1/20 0.32
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL6710306 0.98 KDM4E (0.37) GSK3BABL1KDM4ENPC1RAB9A
SCHEMBL6713424 0.97 GSK3B (0.40) GSK3BABL1KDM4EMAPTPLA2G7
SCHEMBL6708822 0.91 RORC (0.34) GSK3BABL1MAPTPLA2G7RORC
SCHEMBL6714108 0.90 JAK2 (0.35) PLA2G7
SCHEMBL6714100 0.90 JAK2 (0.35) PLA2G7
SCHEMBL6714113 0.90 JAK2 (0.35) PLA2G7
SCHEMBL6713905 0.90 PAX8 (0.34) GSK3BABL1KDM4ENPC1RAB9A
SCHEMBL6711491 0.88 GRIK1 (0.41) GSK3BNPC1RAB9AALDH1A1PLA2G7
SCHEMBL6707746 0.88 GRIK1 (0.39) KDM4ENPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL6711369 0.87 KMT2A (0.42) NPC1RAB9ASMN1; SMN2USP30RORC

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 GSK3B 4467/4885ABL1 344/4885KDM4E 1582/4885

“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.