SCHEMBL6971332

SCHEMBL6971332

[CH2]OC(=O)c1ccoc1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CFTR P13569 1/20 0.30
CES2 O00748 1/20 0.30

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
SCHEMBL6971620 0.77 SMN1; SMN2 (0.35) SCDSMN1; SMN2RXFP1LMNAHTT
SCHEMBL939256 0.77 XDH (0.39) SMN1; SMN2RXFP1HPGDCFTR
SCHEMBL3633653 0.76 SMN1; SMN2 (0.38) SCDSMN1; SMN2RXFP1LMNAHTT
SCHEMBL6464252 0.71 CFTR (0.44) SMN1; SMN2RXFP1LMNAHTTHPGD
SCHEMBL6971991 0.68 TP53 (0.36) SMN1; SMN2HPGDTSHR
SCHEMBL513905 0.67 LMNA (0.55) SMN1; SMN2LMNACES2
SCHEMBL18049534 0.62 SMN1; SMN2 (0.37) SMN1; SMN2RXFP1LMNAHTTHPGD
SCHEMBL6968021 0.62 CES2 (0.59) HPGDTSHRCES2
SCHEMBL9625067 0.62 KDM4E (0.50) LMNAHPGD
SCHEMBL18049526 0.59 NOS3 (0.31)

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP claimed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed