SCHEMBL14828795

SCHEMBL14828795

O=C(O)N1CCN(c2nc3ncc(Cl)cc3nc2Cl)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 9/20 0.38
HRH3 Q9Y5N1 4/20 0.38
HTR3A P46098 2/20 0.37
ABL1 P00519 3/20 0.36
BCR P11274 3/20 0.36
HTR3B O95264 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TRPV1 Q8NER1 4/20 0.35
PHGDH O43175 1/20 0.35
CLK1 P49759 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
SCHEMBL14828834 0.95 HRH4 (0.39) HRH4HRH3HTR3AABL1BCR
SCHEMBL14828999 0.88 ABL1 (0.39) HRH4HRH3HTR3AABL1BCR
SCHEMBL14828901 0.84 GPR6 (0.35) HRH4HRH3HTR3AABL1BCR
SCHEMBL30389146 0.83 POLB (0.44)
SCHEMBL14829286 0.83 POLB (0.44)
SCHEMBL14828829 0.81 HRH4 (0.56) HRH4HRH3HTR3AHTR3B
SCHEMBL14829306 0.81 HRH4 (0.36) HRH4HRH3TRPV1PHGDH
SCHEMBL14829045 0.80 HRH4 (0.42) HRH4TRPV1
SCHEMBL14829024 0.79 CKS1B (0.47)
SCHEMBL14828937 0.78 HRH3 (0.47) HRH4HRH3HTR3AHTR3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3461825-B1 NOVEL HETEROCYCLIC DERIVATIVES AND THEIR USES C&C RES LAB (KR) 2023-06-07 EP disclosed
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 1/4885HRH3 4/4885HTR3A 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.