SCHEMBL4597650

SCHEMBL4597650

O=C(CC1(O)C(=O)N(Cc2ccc3c(c2)OCO3)c2ccccc21)c1cccs1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.75
SCN9A Q15858 7/20 0.71
GAA P10253 3/20 0.70
LMNA P02545 2/20 0.70
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
TSHR P16473 2/20 0.52
MAPT P10636 3/20 0.51
HSD17B10 Q99714 2/20 0.51
USP2 O75604 1/20 0.51
ALOX15 P16050 1/20 0.51
TP53 P04637 1/20 0.51
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL5421560 0.83 SCN9A (1.00) ALDH1A1SCN9ALMNATSHRMAPT
SCHEMBL4596114 0.83 ALDH1A1 (0.77) ALDH1A1SCN9AGAALMNAMEN1
SCHEMBL20989297 0.79 ALDH1A1 (0.70) ALDH1A1SCN9ALMNATSHRMAPT
SCHEMBL20988874 0.79 ALDH1A1 (0.85) ALDH1A1SCN9AGAALMNAMEN1
SCHEMBL4597431 0.76 SCN9A (0.68) ALDH1A1SCN9ALMNAMEN1KMT2A
SCHEMBL4728008 0.74 SCN9A (1.00) ALDH1A1SCN9ATSHRMAPTHSD17B10
SCHEMBL20988869 0.73 ALDH1A1 (0.76) ALDH1A1SCN9AGAALMNAMEN1
SCHEMBL25201619 0.73 HPGD (0.67) ALDH1A1GAALMNAMEN1KMT2A
SCHEMBL4597168 0.71 SCN9A (0.77) ALDH1A1SCN9AMAPTHSD17B10TP53
SCHEMBL4597756 0.71 SCN9A (0.74) SCN9A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101213174-A Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC (CA) 2008-07-02 CN claimed
EP-1877378-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-01-16 EP claimed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US claimed
WO-2006113864-A2 OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2006-10-26 WO claimed
CN-101213174-A Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC (CA) 2008-07-02 CN disclosed
WO-2008046083-A2 USE OF OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-04-17 WO disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 US disclosed
US-20070105820-A1 Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2007-05-10 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-20070105820-A1 Oxindole compounds and their uses as therapeutic agents OPRL1, OPRK1, TRPV1 ALDH1A1 1136/4885SCN9A 148/4885GAA 3046/4885

“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.