SCHEMBL16615844

SCHEMBL16615844

Cc1ncc(CNC(=O)c2ccc(CNC(=O)c3ccc(Cl)c(Cl)c3)cn2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.51
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 1/20 0.48
LMNA P02545 1/20 0.46
MAOB P27338 1/20 0.45
KMT2A Q03164 1/20 0.44
HPGD P15428 3/20 0.44
CCR2 P41597 1/20 0.44
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ROCK2 O75116 1/20 0.41

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
SCHEMBL16615814 0.88 GRIN2A (0.61) EPHX2HDAC4HDAC1HDAC7HDAC11
SCHEMBL16615929 0.84 GRIN2A (0.49) GRIN1GRIN2ALMNAKMT2APOLB
SCHEMBL16615798 0.84 HPGD (0.47) GRIN1GRIN2ALMNAKMT2AHPGD
SCHEMBL16615875 0.83 GRIN2A (0.67) GRIN1GRIN2ALMNAKMT2AHPGD
SCHEMBL16615794 0.82 GRIN2A (0.49) GRIN1GRIN2ALMNAKMT2AHPGD
SCHEMBL16615837 0.81 VNN1 (0.48) GRIN1GRIN2AROCK2
SCHEMBL16615793 0.80 GRIN2A (0.45) GRIN1GRIN2ALMNAHPGDPOLB
SCHEMBL16713096 0.80 GRIN2A (0.44) GRIN1GRIN2AHPGDHTTSMN1; SMN2
SCHEMBL16615789 0.80 GRIN2A (0.53) GRIN1GRIN2AHPGDHTTKDM4E
SCHEMBL16615882 0.77 GRIN2A (0.69) GRIN1GRIN2ALMNAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9963434-B2 N-arylmethyl sulfonamide negative modulators of NR2A LUC THERAPEUTICS, INC. (US) 2018-05-08 US disclosed
US-9963434-B2 N-arylmethyl sulfonamide negative modulators of NR2A LUC THERAPEUTICS, INC. (US) 2018-05-08 US disclosed
US-20160311782-A1 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A NOVARTIS AG (CH) 2016-10-27 US disclosed
US-20160311782-A1 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A NOVARTIS AG (CH) 2016-10-27 US disclosed
US-20150141433-A1 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A MNEMOSYNE PHARMACEUTICALS, INC. 2015-05-21 US disclosed
US-20150141433-A1 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A MNEMOSYNE PHARMACEUTICALS, INC. 2015-05-21 US disclosed
WO-2015048503-A2 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A MNEMOSYNE PHARMACEUTICALS, INC. (US) 2015-04-02 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 (2 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-20160311782-A1 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A GRIN2A, GRIN2B, NR2C2 EPHX2 3637/4885HDAC4 728/4885HDAC1 295/4885
US-20150141433-A1 N-ARYLMETHYL SULFONAMIDE NEGATIVE MODULATORS OF NR2A GRIN2A, GRIN2B, NR2C2 EPHX2 3637/4885HDAC4 728/4885HDAC1 295/4885

“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.