SCHEMBL724361

SCHEMBL724361

CC(C)C(N)(CC(c1ccccc1)c1cc(Br)ccc1OCc1ccccc1)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 6/20 0.48
ALDH1A1 P00352 2/20 0.47
RAB9A P51151 1/20 0.47
HTR7 P34969 1/20 0.45
HTR6 P50406 1/20 0.45
LMNA P02545 3/20 0.42
SLC6A4 P31645 1/20 0.40
USP28 Q96RU2 1/20 0.40
USP25 Q9UHP3 1/20 0.40
HTT P42858 2/20 0.39
PTPN1 P18031 1/20 0.39
AAK1 Q2M2I8 2/20 0.38
USP2 O75604 1/20 0.38
MAOB P27338 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL9220687 0.85 CHRM2 (0.43) CCR5RAB9AHTR7HTR6HTT
SCHEMBL9207681 0.83 MRGPRX4 (0.46) RAB9ASMN1; SMN2
SCHEMBL15148414 0.82 CCR5 (0.53) CCR5ALDH1A1RAB9AHTR7HTR6
SCHEMBL724632 0.82 CCR5 (0.53) CCR5ALDH1A1RAB9AHTR7HTR6
Hydrochloric Acid SCHEMBL2599577 0.82 MRGPRX4 (0.45) RAB9ASMN1; SMN2
SCHEMBL1900590 0.81 HPGD (0.45) RAB9ALMNASMN1; SMN2
SCHEMBL11890513 0.80 CCR5 (0.56) CCR5ALDH1A1RAB9AHTR7HTR6
SCHEMBL15150708 0.79 CCR5 (0.47) CCR5ALDH1A1RAB9AHTR7HTR6
SCHEMBL27530657 0.79 CCR5 (0.47) CCR5ALDH1A1RAB9AHTR7HTR6
SCHEMBL9276697 0.79 CCR5 (0.53) CCR5ALDH1A1RAB9AHTR7HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012025941-A2 PROCESSES FOR THE PREPARATION OF FESOTERODINE CADILA HEALTHCARE LIMITED (IN) 2012-03-01 WO claimed
WO-2012025941-A2 PROCESSES FOR THE PREPARATION OF FESOTERODINE CADILA HEALTHCARE LIMITED (IN) 2012-03-01 WO disclosed
WO-2009037569-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF FESOTERODINE ACTAVIS GROUP PTC EHF (IS) 2009-03-26 WO disclosed
EP-1019358-A1 NOVEL COMPOUNDS, THEIR USE AND PREPARATION Pharmacia & Upjohn AB (SE) 2000-07-19 EP disclosed
WO-1998043942-A1 NOVEL COMPOUNDS, THEIR USE AND PREPARATION PHARMACIA & UPJOHN AB (SE) 1998-10-08 WO disclosed
EP-0667852-A1 NOVEL 3,3-DIPHENYLPROPYLAMINES, THEIR USE AND PREPARATION Pharmacia & Upjohn Aktiebolag (SE) 1995-08-23 EP disclosed
WO-1994011337-A9 NOVEL 3,3-DIPHENYLPROPYLAMINES, THEIR USE AND PREPARATION 1995-07-06 WO disclosed
WO-1994011337-A1 NOVEL 3,3-DIPHENYLPROPYLAMINES, THEIR USE AND PREPARATION PHARMACIA AB (SE) 1994-05-26 WO disclosed