SCHEMBL24228552

SCHEMBL24228552

Cc1cnc(CC2CCNCC2)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.44
HRH4 Q9H3N8 4/20 0.44
CACNA1H O95180 2/20 0.41
GBA1 P04062 1/20 0.41
CACNA1G O43497 1/20 0.39
SLC6A4 P31645 1/20 0.37
KDM1A O60341 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL20204729 0.89 POLB (0.37) HRH3HRH4POLB
SCHEMBL20201744 0.86 PDE9A (0.39) HRH4POLB
SCHEMBL15219254 0.70 HRH3 (0.45) HRH3HRH4CACNA1HGBA1CACNA1G
SCHEMBL8489672 0.69 HPGDS (0.48) HRH3HRH4
SCHEMBL2514697 0.69 HRH3 (0.47) HRH3HRH4CACNA1HGBA1CACNA1G
SCHEMBL22751285 0.68 HRH3 (0.33) HRH3KDM1A
Hydrochloric Acid SCHEMBL22468947 0.68 HPGDS (0.47) HRH3HRH4
SCHEMBL1299385 0.68 HRH3 (0.46) HRH3HRH4CACNA1HGBA1CACNA1G
SCHEMBL20088429 0.68 CACNA1H (0.64) CACNA1HCACNA1GTDP1
SCHEMBL5687883 0.68 KDM1A (0.44) HRH3HRH4GBA1SLC6A4KDM1A

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-11236047-B2 Combination of isoindolinone derivatives with SGI-110 ASTEX THERAPEUTICS LIMITED (GB) 2022-02-01 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-11236047-B2 Combination of isoindolinone derivatives with SGI-110 SGK3, SGK2, GDI2 HRH3 2042/4885HRH4 1680/4885CACNA1H 1440/4885

“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.