SCHEMBL6153101

SCHEMBL6153101

FC(F)(F)COC(N[C@H]1CCCN[C@H]1c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 14/20 0.49
CYP2D6 P10635 5/20 0.47
TP53 P04637 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
THPO P40225 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
Hydrochloric Acid SCHEMBL8917606 0.99 TACR1 (0.48) TACR1CYP2D6TP53CYP1A2CYP3A4
SCHEMBL14414161 0.74 TACR1 (0.52) TACR1CYP2D6
SCHEMBL7168080 0.74 TACR1 (0.49) TACR1CYP2D6
SCHEMBL3373697 0.73 TACR1 (0.57) TACR1
SCHEMBL7250070 0.73 TACR1 (0.54) TACR1CYP2D6
SCHEMBL4917005 0.71 TACR1 (0.77) TACR1CYP2D6
Hydrochloric Acid SCHEMBL4914589 0.70 TACR1 (0.75) TACR1CYP2D6
SCHEMBL6699054 0.69 TACR1 (0.70) TACR1CYP2D6
SCHEMBL8630684 0.69 TACR1 (0.48) TACR1CYP2D6
SCHEMBL8630688 0.69 TACR1 (0.48) TACR1CYP2D6

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027892-B1 Azithromycin combination for emesis control in dogs PFIZER PROD INC (US) 2005-08-17 EP claimed
US-20040063649-A1 Azithromycin combination for emesis control in mammals PFIZER INC 2004-04-01 US claimed
US-20030018049-A1 Azithromycin combination for emesis control in mammals GODEK DENNIS M (US) 2003-01-23 US claimed
US-20020016301-A1 Azithromycin combination for emesis control in mammals GODEK DENNIS M (US) 2002-02-07 US claimed
EP-1027892-A2 Azithromycin combination for emesis control in dogs Pfizer Products Inc. (US) 2000-08-16 EP claimed
EP-0854720-B1 NK-1 RECEPTOR ANTAGONISTS FOR PREVENTION OF NEUROGENIC INFLAMMATION IN GENE THERAPY PFIZER (US) 1999-08-04 EP claimed
EP-0773026-A2 NK-1 receptor antagonists for the treatment of cancer PFIZER INC. (US) 1997-05-14 EP claimed
EP-0659409-A2 Substance 1 antagonists for the inhibition of angiogenesis PFIZER INC. (US) 1995-06-28 EP claimed
EP-0655246-A1 Substance P antagonists for the treatment of disorders caused by helicobacter pylori or other spiral urease-positive gram-negative bacteria PFIZER INC. (US) 1995-05-31 EP claimed
US-5393762-A Pharmaceutical agents for treatment of emesis PFIZER INC. (US) 1995-02-28 US claimed
EP-0627221-A2 Substance P antagonists for the treatment of emesis PFIZER INC. (US) 1994-12-07 EP claimed
US-5340826-A Pharmaceutical agents for treatment of urinary incontinence PFIZER INC. (US) 1994-08-23 US claimed
EP-1027892-B1 Azithromycin combination for emesis control in dogs PFIZER PROD INC (US) 2005-08-17 EP disclosed
US-20040063649-A1 Azithromycin combination for emesis control in mammals PFIZER INC 2004-04-01 US disclosed
US-20030018049-A1 Azithromycin combination for emesis control in mammals GODEK DENNIS M (US) 2003-01-23 US disclosed
US-20020016301-A1 Azithromycin combination for emesis control in mammals GODEK DENNIS M (US) 2002-02-07 US disclosed
EP-0655246-A1 Substance P antagonists for the treatment of disorders caused by helicobacter pylori or other spiral urease-positive gram-negative bacteria PFIZER INC. (US) 1995-05-31 EP disclosed
US-5393762-A Pharmaceutical agents for treatment of emesis PFIZER INC. (US) 1995-02-28 US disclosed
EP-0627221-A2 Substance P antagonists for the treatment of emesis PFIZER INC. (US) 1994-12-07 EP disclosed
US-5340826-A Pharmaceutical agents for treatment of urinary incontinence PFIZER INC. (US) 1994-08-23 US disclosed