SCHEMBL6818243

SCHEMBL6818243

COC(=O)c1cc(-c2ccccc2F)on1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
TP53 P04637 1/20 0.54
RAB9A P51151 7/20 0.52
NPC1 O15118 5/20 0.52
HSD17B10 Q99714 7/20 0.52
ALDH1A1 P00352 6/20 0.52
HPGD P15428 5/20 0.52
KMT2A Q03164 4/20 0.52
NPSR1 Q6W5P4 3/20 0.52
MEN1 O00255 3/20 0.52
NOTUM Q6P988 2/20 0.51
MAPK1 P28482 1/20 0.51
KDM4E B2RXH2 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ACKR3 P25106 1/20 0.48
SCD5 Q86SK9 1/20 0.48
TSHR P16473 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
PPARG P37231 1/20 0.46

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
SCHEMBL21523795 0.85 MAPT (0.51) MAPTTP53RAB9ANPC1HSD17B10
SCHEMBL6818530 0.84 MAPT (0.55) MAPTTP53RAB9ANPC1HSD17B10
SCHEMBL4258916 0.84 MAPT (0.59) MAPTTP53RAB9ANPC1ALDH1A1
SCHEMBL1544585 0.83 TP53 (0.51) MAPTTP53RAB9ANPC1HSD17B10
SCHEMBL21361939 0.82 NPC1 (0.65) MAPTTP53RAB9ANPC1ALDH1A1
SCHEMBL6822322 0.82 NOTUM (0.60) MAPTTP53RAB9ANPC1HSD17B10
SCHEMBL70022 0.81 ALDH1A1 (0.62) MAPTRAB9ANPC1HSD17B10ALDH1A1
SCHEMBL12171833 0.81 RAB9A (0.55) MAPTTP53RAB9ANPC1ALDH1A1
SCHEMBL21645384 0.81 RAB9A (0.51) MAPTRAB9ANPC1HSD17B10ALDH1A1
SCHEMBL30140611 0.80 NPC1 (0.50) MAPTTP53RAB9ANPC1HSD17B10

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-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US disclosed
WO-2004018428-A1 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 MAPT 4759/4885TP53 2331/4885RAB9A 4337/4885

“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.