Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6208010

CCOc1cccc(CN2CCC(Nc3cc(=O)oc4ccc(OCC)cc34)CC2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 11/20 0.56
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAOB P27338 3/20 0.51
MAPT P10636 1/20 0.48
KCNH2 Q12809 1/20 0.48

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
Trifluoroacetic Acid SCHEMBL6313316 0.97 MCHR1 (0.61) MCHR1MEN1KMT2AKDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL6210165 0.92 MCHR1 (0.66) MCHR1MAOBKCNH2
SCHEMBL6186001 0.89 MCHR1 (0.69) MCHR1MEN1KMT2AKDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL6208356 0.89 MCHR1 (0.64) MCHR1MEN1KMT2AKDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL6208550 0.87 MCHR1 (0.66) MCHR1MAOBKCNH2
Trifluoroacetic Acid SCHEMBL6208900 0.87 MCHR1 (0.64) MCHR1MAOBKCNH2
Trifluoroacetic Acid SCHEMBL6208461 0.87 MCHR1 (0.64) MCHR1MAOBKCNH2
Trifluoroacetic Acid SCHEMBL6188612 0.84 MCHR1 (0.69) MCHR1MAOBKCNH2
SCHEMBL6187459 0.84 MCHR1 (0.76) MCHR1KCNH2
Trifluoroacetic Acid SCHEMBL6207368 0.83 MCHR1 (0.67) MCHR1MAOBKCNH2

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-1534703-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR ABBOTT LABORATORIES (US) 2005-06-01 EP disclosed
WO-2003106452-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-12-24 WO disclosed