SCHEMBL6989409

SCHEMBL6989409

CCOC(=O)N1CCC(=C2c3ccccc3CCn3c(CO)cnc32)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 9/20 0.61
SLC6A15 Q9H2J7 7/20 0.48
LMNA P02545 2/20 0.48
FNTA P49354 2/20 0.48
FNTB P49356 2/20 0.48
USP2 O75604 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
CACNA1F O60840 1/20 0.48
NR1I2 O75469 1/20 0.48
GMNN O75496 1/20 0.48
ABCB11 O95342 1/20 0.48
TP53 P04637 1/20 0.48
CHRM2 P08172 1/20 0.48
ABCB1 P08183 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2D6 P10635 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL7095204 0.87 HRH1 (0.62) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL6988373 0.86 HRH1 (0.61) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL6991396 0.85 HRH1 (0.60) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL5060512 0.85 SETD7 (0.52) HRH1LMNAFNTAFNTBMEN1
SCHEMBL6988256 0.81 HRH1 (0.57) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL9850494 0.80 HRH1 (0.76) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL15790874 0.80 HRH1 (0.39) HRH1LMNAFNTAFNTBMEN1
SCHEMBL18102086 0.78 HRH1 (0.67) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL7136762 0.78 HRH1 (0.64) HRH1SLC6A15LMNAFNTAFNTB
SCHEMBL15773559 0.77 SETD7 (0.54) HRH1LMNAMEN1ABCB11TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2978765-B1 METHODS FOR THE PREPARATION OF ALCAFTADINE CRYSTAL PHARMA SAU (ES) 2018-05-02 EP disclosed
US-9682984-B2 Methods for the preparation of alcaftadine CRYSTAL PHARMA S.A.U. (ES) 2017-06-20 US disclosed
US-9682984-B2 Methods for the preparation of alcaftadine CRYSTAL PHARMA S.A.U. (ES) 2017-06-20 US disclosed
US-20160280709-A1 METHODS FOR THE PREPARATION OF ALCAFTADINE CRYSTAL PHARMA S.A.U. (ES) 2016-09-29 US disclosed
US-20160280709-A1 METHODS FOR THE PREPARATION OF ALCAFTADINE CRYSTAL PHARMA S.A.U. (ES) 2016-09-29 US disclosed
EP-0588858-B1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA NV (BE) 2003-09-17 EP disclosed
US-5468743-A Imidazo[2,1-b]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1995-11-21 US disclosed
EP-0588858-A1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-30 EP disclosed
WO-1992022551-A1 IMIDAZO[2,1-b][3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-23 WO disclosed
EP-0518435-A1 Imidazo[2,1-b][3]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP 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-20160280709-A1 METHODS FOR THE PREPARATION OF ALCAFTADINE NISCH, CMA1, ADRA2C HRH1 86/4885SLC6A15 457/4885LMNA 3319/4885

“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.