SCHEMBL15445696

SCHEMBL15445696

Cc1ccc(C(=O)NNC(=O)CCc2ccc(NS(C)(=O)=O)cc2)cc1Cl

nearest known ligand 0.84

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 10/20 0.84
GRIN2B Q13224 10/20 0.84
KCNH2 Q12809 2/20 0.53
GAA P10253 2/20 0.48
MAPT P10636 1/20 0.48
AGTR1 P30556 1/20 0.48
KDM4E B2RXH2 2/20 0.46
CYP2C9 P11712 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
DUSP3 P51452 1/20 0.45
PTPN5 P54829 1/20 0.45
PTPN11 Q06124 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NPC1 O15118 1/20 0.43

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
SCHEMBL12576841 0.91 GRIN1 (0.84) GRIN1GRIN2BKCNH2KDM4ECYP2C9
SCHEMBL12576833 0.83 GRIN1 (0.84) GRIN1GRIN2BKCNH2
SCHEMBL7997186 0.77 GRIN1 (0.76) GRIN1GRIN2BKCNH2MEN1KMT2A
SCHEMBL15445695 0.76 GRIN1 (0.84) GRIN1GRIN2BKCNH2
SCHEMBL12576823 0.73 GRIN1 (0.88) GRIN1GRIN2BKCNH2MAPT
SCHEMBL12576808 0.72 GRIN1 (0.52) GRIN1GRIN2BKCNH2MAPTKDM4E
SCHEMBL12576815 0.71 GRIN1 (0.64) GRIN1GRIN2BGAAMAPTMEN1
SCHEMBL12576832 0.70 KMT2A (0.53) GRIN1GRIN2BGAAMEN1KMT2A
SCHEMBL9440112 0.70 KDM4E (0.58) GRIN1GRIN2BKCNH2KDM4E
SCHEMBL18455366 0.70 SCN9A (0.59) MEN1KMT2ANPC1

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-9079852-B2 NMDA receptor antagonists for neuroprotection EMORY UNIVERSITY (US) 2015-07-14 US disclosed
US-20140031363-A1 NMDA Receptor Antagonists for Neuroprotection LIOTTA DENNIS C (US) 2014-01-30 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-20140031363-A1 NMDA Receptor Antagonists for Neuroprotection GRIN1, GRIN2C, GRIK1 GRIN1 1/4885GRIN2B 7/4885KCNH2 135/4885

“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.