SCHEMBL14828993

SCHEMBL14828993

CN1CCN(c2nc3nc(Cl)c(Cl)cc3nc2Cl)CC1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 11/20 0.59
HTR3B O95264 1/20 0.59
HTR3A P46098 1/20 0.59
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
HRH3 Q9Y5N1 1/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40

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
SCHEMBL23234469 0.85 HRH4 (0.56) HRH4HTR3BHTR3AALOX15SMN1; SMN2
SCHEMBL30223251 0.84 HRH4 (0.73) HRH4HTR3BHTR3ASMN1; SMN2HTR1A
SCHEMBL405806 0.84 HRH4 (0.73) HRH4HTR3BHTR3ASMN1; SMN2HTR1A
SCHEMBL14828758 0.84 HRH4 (0.48) HRH4HTR3BHTR3AALOX15HTR1A
SCHEMBL14828818 0.80 HRH4 (0.54) HRH4HTR3BHTR3AALOX15SMN1; SMN2
SCHEMBL14828829 0.79 HRH4 (0.56) HRH4HTR3BHTR3ASMN1; SMN2HRH3
SCHEMBL6358386 0.79 HRH4 (0.66) HRH4HTR3BHTR3AHTR1ADRD2
SCHEMBL5772609 0.79 HRH4 (0.66) HRH4HTR3BHTR3ASMN1; SMN2
SCHEMBL405876 0.79 HRH4 (0.66) HRH4HTR3BHTR3ASMN1; SMN2
SCHEMBL14828844 0.78 HRH4 (0.55) HRH4HTR3BHTR3ASMN1; SMN2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3461825-A1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C Research Laboratories (KR) 2019-04-03 EP disclosed
EP-2760865-B1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RES LAB (KR) 2018-07-11 EP disclosed
US-9586959-B2 Substituted tricyclic heterocycles as histamine 4 receptor inhibitors C&C RESEARCH LABORATORIES (KR) 2017-03-07 US disclosed
US-20140315888-A1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RESEARCH LABORATORIES (KR) 2014-10-23 US disclosed
EP-2760865-A2 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C Research Laboratories (KR) 2014-08-06 EP disclosed
WO-2013048214-A2 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RESEARCH LABORATORIES (KR) 2013-04-04 WO 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-20140315888-A1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES HRH4, HRH2, HRH1 HRH4 1/4885HTR3B 452/4885HTR3A 353/4885

“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.