SCHEMBL23242514

SCHEMBL23242514

Cc1ccc2c(c1)Oc1cc(Cl)ccc1N=C2N1CCNCC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 13/20 0.63
HRH1 P35367 10/20 0.63
HTR2C P28335 3/20 0.61
HRH2 P25021 2/20 0.61
HTR1A P08908 2/20 0.61
ADRA2A P08913 2/20 0.61
KDM4E B2RXH2 1/20 0.61
MEN1 O00255 1/20 0.61
USP2 O75604 1/20 0.61
ALDH1A1 P00352 1/20 0.61
LMNA P02545 1/20 0.61
TP53 P04637 1/20 0.61
CYP1A2 P05177 1/20 0.61
ADRB2 P07550 1/20 0.61
CHRM2 P08172 1/20 0.61
CHRM4 P08173 1/20 0.61
CYP3A4 P08684 1/20 0.61
CHRM5 P08912 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
CYP2D6 P10635 1/20 0.61

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
SCHEMBL29800580 1.00 HTR2A (0.63) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL3405542 0.86 HTR2A (0.64) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL3409689 0.85 DRD2 (0.80) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL2615196 0.84 DRD2 (0.74) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL3411352 0.80 HRH4 (0.64) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL3412948 0.80 HRH1 (0.71) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL23298962 0.79 DRD2 (0.49) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL2615389 0.78 HRH4 (0.77) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL3410976 0.78 DRD2 (0.63) HTR2AHRH1HTR2CHRH2HTR1A
SCHEMBL23242504 0.78 HTR2A (1.00) 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 5 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
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.