SCHEMBL23242584

SCHEMBL23242584

CCCc1ccc2c(c1)Oc1cc(Cl)ccc1N=C2N1CCN(CC(C)(C)C(=O)OC)CC1

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 15/20 0.83
HRH1 P35367 9/20 0.83
HTR2C P28335 7/20 0.57
DRD2 P14416 1/20 0.49
DRD1 P21728 1/20 0.49
HTR2B P41595 1/20 0.49

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
SCHEMBL29800713 1.00 HTR2A (0.83) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL23242529 0.91 HTR2A (1.00) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL29800703 0.91 HTR2A (1.00) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL29800699 0.89 HTR2A (0.82) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL23242590 0.89 HTR2A (0.82) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL23242541 0.88 HTR2A (0.86) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL29800648 0.88 HTR2A (0.86) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL23242566 0.86 HTR2A (0.83) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL23242545 0.86 HTR2A (0.83) HTR2AHRH1HTR2CDRD2DRD1
SCHEMBL29893792 0.86 HTR2A (0.83) HTR2AHRH1HTR2CDRD2DRD1

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-4048667-B1 3-(4-(11H-DIBENZO[B,E][1,4]AZEPIN-6-YL)PIPERAZIN-1-YL)- AND 3-(4-(DIBENZO[B,F][1,4]OXAZEPIN/THIAZEPIN/DIAZEPIN-11-YL)PIPERAZIN-1-YL)-PROPANOIC ACID DERIVATIVES AS H1 AND 5-HT2A-RECEPTOR MODULATORS FOR THE TREATMENT OF SLEEP DISORDERS ALAIRION INC (US) 2024-07-03 EP disclosed
US-11046651-B2 Piperazine substituted azapine derivatives and uses thereof ALAIRION, INC. (US) 2021-06-29 US disclosed
US-11046651-B2 Piperazine substituted azapine derivatives and uses thereof ALAIRION, INC. (US) 2021-06-29 US disclosed
WO-2021080997-A1 3-(4-(11H-DIBENZO[B,E][1,4]AZEPIN-6-YL)PIPERAZIN-1-YL)- AND 3-(4-(DIBENZO[B,F][1,4]OXAZEPIN/THIAZEPIN/DIAZEPIN-11-YL)PIPERAZIN-1-YL)-PROPANO IC ACID DERIVATIVES AS H1 AND 5-HT2A-RECEPTOR MODULATORS FOR THE TREATMENT OF SLEEP DISORDERS ALAIRION, INC. (US) 2021-04-29 WO disclosed
US-20210114989-A1 PIPERAZINE SUBSTITUTED AZAPINE DERIVATIVES AND USES THEREOF Neumora Therapeutics, Inc. 2021-04-22 US disclosed
US-20210114989-A1 PIPERAZINE SUBSTITUTED AZAPINE DERIVATIVES AND USES THEREOF Neumora Therapeutics, Inc. 2021-04-22 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 (2 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-11046651-B2 Piperazine substituted azapine derivatives and uses thereof HTR2A, HTR5A, HTR2C HTR2A 1/4885HRH1 30/4885HTR2C 3/4885
US-20210114989-A1 PIPERAZINE SUBSTITUTED AZAPINE DERIVATIVES AND USES THEREOF HTR2A, HTR5A, HTR2C HTR2A 1/4885HRH1 30/4885HTR2C 3/4885

“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.