SCHEMBL2533770

SCHEMBL2533770

Fc1c(Cl)ccc2nc(N3CCNCC3)n3ncnc3c12

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 10/20 0.39
HTR3A P46098 2/20 0.36
HRH4 Q9H3N8 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL2464857 0.86 HRH4 (0.50) SOS1HTR3AHRH4HRH3
SCHEMBL12225078 0.86 SOS1 (0.41) SOS1HRH4
SCHEMBL2533033 0.86 SOS1 (0.35) SOS1HTR3A
Hydrochloric Acid SCHEMBL2466905 0.85 SOS1 (0.35) SOS1HTR3A
SCHEMBL2465334 0.84 CYP1A2 (0.40) SOS1HTR3A
SCHEMBL2532585 0.77 HRH4 (0.42) SOS1HRH4HRH3
SCHEMBL12224910 0.77 HRH4 (0.42) SOS1HRH4HRH3
SCHEMBL404537 0.76 HRH4 (0.49) SOS1HTR3AHRH4HRH3
SCHEMBL2530224 0.73 HRH4 (0.40) SOS1HTR3AHRH4HRH3
SCHEMBL12225096 0.73 HRH4 (0.46) SOS1HTR3AHRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110257137-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-10-20 US disclosed
US-20110257137-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-10-20 US disclosed
US-20110257137-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE KALYPSYS, INC. (US) 2011-10-20 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-20110257137-A1 HETEROCYCLIC INHIBITORS OF HISTAMINE RECEPTORS FOR THE TREATMENT OF DISEASE HRH4, HRH3, HRH2 SOS1 3564/4885HTR3A 153/4885HRH4 1/4885

“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.