SCHEMBL5621041

SCHEMBL5621041

CCN1CNS(O)(O)c2cc(Oc3cccc(NS(C)(=O)=O)c3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 7/20 0.40
PGR P06401 1/20 0.38
POLB P06746 1/20 0.37
PIP4K2A P48426 1/20 0.37
PIP4K2B P78356 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
BTK Q06187 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CACNA1B Q00975 1/20 0.35
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
NR3C1 P04150 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
SCHEMBL5484644 0.90 GRIA2 (0.40) GRIA2PGRPOLBPIP4K2APIP4K2B
SCHEMBL5621042 0.89 GRIA2 (0.53) GRIA2PGRDRD2DRD4DRD3
SCHEMBL5620019 0.89 GRIA2 (0.39) GRIA2PGRALDH1A1LMNAPKM
SCHEMBL5482709 0.80 LTA4H (0.41) GRIA2PGRGRIN1GRIN2BLMNA
SCHEMBL5619273 0.80 NPC1 (0.46) GRIA2POLBALDH1A1
SCHEMBL5619210 0.80 GRIA2 (0.43) GRIA2POLBALDH1A1SMN1; SMN2
SCHEMBL5484649 0.79 GRIA2 (0.51) GRIA2PGR
SCHEMBL5620626 0.79 PARP10 (0.47) GRIA2BTK
SCHEMBL5620012 0.78 GRIA2 (0.52) GRIA2
SCHEMBL5619342 0.78 GRIA2 (0.40) GRIA2

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-7253161-B2 Benzothiazine and benzothiadiazine derivatives method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2007-08-07 US disclosed
US-20050124606-A1 Novel benzothiazine and benzothiadiazine derivatives method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2005-06-09 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-20050124606-A1 Novel benzothiazine and benzothiadiazine derivatives method for preparing same and pharmaceutical compositions containing same NR4A3, NR5A2, NR4A1 GRIA2 537/4885PGR 589/4885POLB 3574/4885

“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.