SCHEMBL6707656

SCHEMBL6707656

CC12CCC(C(=O)Nc3cccc4cc(C(=O)Nc5ccc(Br)cc5-c5noc(=O)[nH]5)[nH]c34)(OC1=O)C2(C)C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
HTT P42858 3/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 6/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.40
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
GRIK1 P39086 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
SCHEMBL6711720 0.91 ALDH1A1 (0.47) SMN1; SMN2NPC1RAB9AHTTKMT2A
SCHEMBL6710449 0.90 KMT2A (0.43) SMN1; SMN2NPC1RAB9AHTTKMT2A
SCHEMBL6712158 0.88 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AHTTKMT2A
SCHEMBL6711696 0.87 GRIK1 (0.39) POLBLMNAGRIK1
SCHEMBL6708757 0.82 GRIK1 (0.42) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL6708679 0.82 GRIK1 (0.44) POLBGRIK1
SCHEMBL6713707 0.81 MEN1 (0.38) SMN1; SMN2NPC1RAB9AHTTKMT2A
SCHEMBL6713760 0.81 GRIK1 (0.42) KMT2AMEN1GRIK1
SCHEMBL6713262 0.80 GRIK1 (0.41) SMN1; SMN2KMT2AMEN1POLBLMNA
SCHEMBL6710166 0.80 NPC1 (0.43) SMN1; SMN2NPC1RAB9ALMNAGRIK1

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 SMN1; SMN2 2635/4885NPC1 3891/4885RAB9A 3732/4885

“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.