SCHEMBL24417833

SCHEMBL24417833

Nc1cc2n(n1)CCNCC2

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.37
HTR2A P28223 1/20 0.37
HRH4 Q9H3N8 2/20 0.36
NCF1 P14598 1/20 0.33
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
DRD2 P14416 1/20 0.30
CASP1 P29466 1/20 0.30
CASP4 P49662 1/20 0.30
CASP5 P51878 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
SCHEMBL20912789 0.83 PDCD1 (0.43) HTR2CHTR2AHRH4NCF1PDCD1
Hydrochloric Acid SCHEMBL23778209 0.81 PDCD1 (0.43) HTR2CHTR2AHRH4NCF1PDCD1
Hydrochloric Acid SCHEMBL23779043 0.81 PDCD1 (0.43) HTR2CHTR2AHRH4NCF1PDCD1
SCHEMBL27329671 0.78 PDCD1 (0.37) HTR2CHTR2ANCF1PDCD1CD274
SCHEMBL20517214 0.78 HTR2C (0.37) HTR2CHTR2APDCD1CD274CASP1
SCHEMBL26495272 0.75 HTR2C (0.35) HTR2CHTR2APDCD1CD274
SCHEMBL25594644 0.74 GRM5 (0.40) HTR2CHTR2AHRH4PDCD1CD274
SCHEMBL27329663 0.74 HTR2C (0.34) HTR2CHTR2APDCD1CD274
SCHEMBL20092261 0.73
SCHEMBL20461181 0.73 PDCD1 (0.36) HTR2CHTR2AHRH4PDCD1CD274

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-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2022-05-12 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-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS BACE1, ENGASE, GBA3 HTR2C 4513/4885HTR2A 3672/4885HRH4 2653/4885

“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.