SCHEMBL23344685

SCHEMBL23344685

C=Cc1ccc(-c2cc(C(=O)NCc3cccnc3N3CCOCC3)cnn2)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 8/20 0.60
SCN2A Q99250 6/20 0.60
KDM1A O60341 3/20 0.42
HDAC1 Q13547 3/20 0.42
MCHR1 Q99705 2/20 0.40
HPGDS O60760 1/20 0.39
MAPK1 P28482 1/20 0.38
MAPK14 Q16539 1/20 0.38
HTR2C P28335 1/20 0.38
JAK2 O60674 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL23327910 0.89 SCN10A (0.75) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23344751 0.89 SCN10A (0.62) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23327907 0.86 SCN10A (0.66) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23328010 0.85 SCN10A (0.57) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23327995 0.85 SCN10A (0.71) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23327655 0.84 SCN10A (0.68) SCN10ASCN2AKDM1AHDAC1MAPK14
SCHEMBL23327988 0.84 SCN10A (0.57) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23327992 0.84 SCN10A (0.59) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL23327661 0.84 SCN10A (0.57) SCN10ASCN2AKDM1AHDAC1MCHR1
SCHEMBL29195333 0.83 SCN10A (0.56) SCN10ASCN2AKDM1AHDAC1MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210139456-A1 PYRIDAZINE COMPOUNDS FOR INHIBITING NAV1.8 LIEBER INSTITUTE, INC 2021-05-13 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-20210139456-A1 PYRIDAZINE COMPOUNDS FOR INHIBITING NAV1.8 SCN8A, SCN5A, SCN2A SCN10A 8/4885SCN2A 3/4885KDM1A 3241/4885

“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.