SCHEMBL19865638

SCHEMBL19865638

CCCCCCNCc1ncccc1C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 4/20 0.46
HRH4 Q9H3N8 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
LMNA P02545 1/20 0.43
SCN8A Q9UQD0 2/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2D6 P10635 3/20 0.42
CYP2C19 P33261 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SIGMAR1 Q99720 1/20 0.39
ALOX12 P18054 1/20 0.39
ASAH1 Q13510 1/20 0.38

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
SCHEMBL23428554 0.94 SCN8A (0.44) CHRM2HRH4HRH3SCN8ASMN1; SMN2
SCHEMBL19865635 0.83 SMN1; SMN2 (0.54) CHRM2HRH4HRH3LMNACYP1A2
SCHEMBL4620705 0.82 SCN8A (0.42) CHRM2SCN8ASMN1; SMN2MEN1KMT2A
SCHEMBL2082460 0.81 NOS3 (0.45) SCN8A
SCHEMBL20482639 0.81 ADORA2A (0.45) CHRM2SCN8ASMN1; SMN2
SCHEMBL2261106 0.80 NOS3 (0.41)
SCHEMBL6839265 0.78 TDP1 (0.49) LMNASMN1; SMN2MEN1KMT2AALOX12
SCHEMBL29148471 0.78 TDP1 (0.49) LMNASMN1; SMN2MEN1KMT2AALOX12
SCHEMBL26464914 0.78 TDP1 (0.49) LMNASMN1; SMN2MEN1KMT2AALOX12
SCHEMBL27876571 0.78 TDP1 (0.49) LMNASMN1; SMN2MEN1KMT2AALOX12

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-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 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-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE PDE3A, PDE2A, PDE5A CHRM2 1925/4885HRH4 4072/4885HRH3 4261/4885

“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.