SCHEMBL8109750

SCHEMBL8109750

CC(C)C(c1cccnc1)N1CCC(Oc2ccc(Cl)cn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.46
FPR2 P25090 1/20 0.42
PROKR1 Q8TCW9 1/20 0.42
HRH3 Q9Y5N1 3/20 0.40
CYP3A4 P08684 4/20 0.39
CYP3A5 P20815 4/20 0.39
HCRTR1 O43613 2/20 0.38
OGA O60502 1/20 0.38
CYP19A1 P11511 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35

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
SCHEMBL20069052 0.80 HRH3 (0.56) MMP1FPR2PROKR1HRH3
SCHEMBL8103918 0.80 OGA (0.48) HRH3OGA
SCHEMBL17339936 0.72 FPR2 (0.57) MMP1FPR2PROKR1HRH3
SCHEMBL8109748 0.71 SCN9A (0.41) MMP1FPR2PROKR1HRH3
SCHEMBL30843204 0.70 FPR2 (0.49) MMP1FPR2PROKR1HRH3HCRTR1
SCHEMBL20069665 0.70 MMP1 (0.45) MMP1FPR2PROKR1HRH3
SCHEMBL7956692 0.69 FPR2 (0.47) MMP1FPR2PROKR1HRH3
SCHEMBL20147421 0.68 OGA (0.57) HRH3OGA
Hydrochloric Acid SCHEMBL2774867 0.67 MMP1 (0.54) MMP1FPR2PROKR1HRH3
SCHEMBL4051291 0.67 FPR2 (0.47) MMP1FPR2PROKR1HRH3HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed