SCHEMBL9617865

SCHEMBL9617865

O=C1NC(=O)C(Cc2ccc(OCCCCCOc3ccc(Cl)cc3)cc2)S1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.66
PPARG P37231 10/20 0.66
HRH3 Q9Y5N1 1/20 0.62
PPARA Q07869 2/20 0.62
MAPT P10636 2/20 0.57
CYP3A4 P08684 2/20 0.57
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
TP53 P04637 1/20 0.57
CYP1A2 P05177 1/20 0.57
HPGD P15428 1/20 0.57
ALOX15 P16050 1/20 0.57
TSHR P16473 1/20 0.57
KMT2A Q03164 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
RXRA P19793 1/20 0.56

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
SCHEMBL8957444 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570697 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570560 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570853 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570566 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570653 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570574 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL9570659 0.93 FFAR1 (0.69) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL6381220 0.91 FFAR1 (0.65) FFAR1PPARGHRH3PPARAMAPT
SCHEMBL11066932 0.90 FFAR1 (0.77) FFAR1PPARGHRH3PPARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4069383-A None JP disclosed
JP-H0469383-A SUBSTITUTED THIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUT CO LTD 1992-03-04 JP disclosed