SCHEMBL23242571

SCHEMBL23242571

COc1ccc2c(c1)C(N1CCN(CC(C)(C)C(=O)O)CC1)=Nc1cc(Cl)ccc1O2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 1.00
HTR2A P28223 13/20 0.78
HRH1 P35367 8/20 0.64
HRH4 Q9H3N8 1/20 0.56
DRD2 P14416 1/20 0.53
DRD1 P21728 1/20 0.53
HTR2B P41595 1/20 0.53

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
SCHEMBL10194071 0.94 HTR2C (0.88) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL10194121 0.91 HTR2C (0.83) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL10194096 0.90 HTR2C (0.82) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL10194117 0.89 HTR2C (0.81) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL10194114 0.89 HTR2C (0.81) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL10194123 0.89 HTR2C (0.80) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL10194054 0.89 HTR2C (0.80) HTR2CHTR2AHRH1DRD2
SCHEMBL23242611 0.89 HTR2C (1.00) HTR2CHTR2AHRH1HRH4DRD2
SCHEMBL29800763 0.88 HTR2A (1.00) HTR2CHTR2AHRH1DRD2DRD1
SCHEMBL23242609 0.88 HTR2A (1.00) HTR2CHTR2AHRH1DRD2DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 HTR2C 3/4885HTR2A 1/4885HRH1 30/4885
US-20210114989-A1 PIPERAZINE SUBSTITUTED AZAPINE DERIVATIVES AND USES THEREOF HTR2A, HTR5A, HTR2C HTR2C 3/4885HTR2A 1/4885HRH1 30/4885

“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.