SCHEMBL22770976

SCHEMBL22770976

[2H]C([2H])(Cl)c1cc(Br)cnc1C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL29603498 1.00 SMN1; SMN2 (0.33) SMN1; SMN2HTTKMT2AS1PR1S1PR3
SCHEMBL22771018 0.84 SMN1; SMN2 (0.35) SMN1; SMN2HTTKMT2AS1PR1S1PR3
SCHEMBL15699752 0.78 SMN1; SMN2 (0.36) SMN1; SMN2HTTKMT2AS1PR1S1PR3
SCHEMBL17427757 0.78 NOS3 (0.39) SMN1; SMN2HTTKMT2AHSD17B10
SCHEMBL31145165 0.76 KDM4E (0.46) SMN1; SMN2HTTKMT2AHSD17B10
SCHEMBL15004184 0.76 KDM4E (0.46) SMN1; SMN2HTTKMT2AHSD17B10
SCHEMBL2066694 0.76 HTT (0.39) SMN1; SMN2HTTKMT2AS1PR1S1PR3
SCHEMBL28166044 0.76 SMN1; SMN2 (0.35) SMN1; SMN2HTTKMT2AS1PR1S1PR3
SCHEMBL30403001 0.74 SMN1; SMN2 (0.34) SMN1; SMN2HTTKMT2AHSD17B10
Methyl Alcohol SCHEMBL10757708 0.74 NOS3 (0.37) SMN1; SMN2HTTKMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11447503-B2 Pyridine carbamates and their use as GLUN2B receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2022-09-20 US disclosed
EP-3983074-A1 PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
WO-2020249799-A1 PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-12-17 WO disclosed
US-20200392154-A1 PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-12-17 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 (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-11447503-B2 Pyridine carbamates and their use as GLUN2B receptor modulators GRIN2B, GRIN2A, GRIN1 SMN1; SMN2 1492/4885HTT 824/4885KMT2A 1397/4885
US-20200392154-A1 PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS GRIN2B, GRIN2A, GRIN1 SMN1; SMN2 1492/4885HTT 824/4885KMT2A 1397/4885

“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.