SCHEMBL7606342

SCHEMBL7606342

CSC(F)(F)C(=O)c1ccc(F)cc1F

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.53
CES1 P23141 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
SNCA P37840 1/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACKR3 P25106 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL6945684 0.83 CES2 (0.50) CES2CES1L3MBTL1HTTKMT2A
SCHEMBL7804366 0.80 CES2 (0.59) CES2CES1L3MBTL1HTTKMT2A
SCHEMBL1748151 0.80 CES1 (0.63) CES2CES1L3MBTL1HTTSNCA
SCHEMBL13151879 0.78 CES2 (0.61) CES2CES1L3MBTL1HTTKMT2A
SCHEMBL7607142 0.78 CES2 (0.47) CES2CES1L3MBTL1RAB9AKDM4E
SCHEMBL9341491 0.77 CES2 (0.59) CES2CES1L3MBTL1HTTKMT2A
SCHEMBL10832422 0.77 CES2 (0.59) CES2CES1L3MBTL1HTTKMT2A
SCHEMBL2097707 0.77 CES2 (0.59) CES2CES1L3MBTL1HTTKMT2A
SCHEMBL6945739 0.76 CES2 (0.42) CES2CES1L3MBTL1CYP11B1CYP11B2
SCHEMBL6945689 0.76 CES2 (0.53) CES2CES1L3MBTL1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1026154-B1 Preparation process of difluoroacetophenone derivatives SSP CO LTD (JP) 2002-09-04 EP disclosed
EP-0780380-B1 Triazole derivatives with antimycotic action and intermediates SS PHARMACEUTICAL CO (JP) 2001-06-13 EP disclosed
US-6229049-B1 COUPLING AN ALKYLTHIODIFLUOROACETIC ACID ESTER DERIVATIVE TO A HALOBENZENE DERIVATIVE AS AN INTERMEDIATE FOR 'TRIAZOLES' FUNGICIDES; TREATING MYCOTIC INFECTIOUS DISEASES SSP CO., LTD. (JP) 2001-05-08 US disclosed
EP-1026154-A2 Preparation process of difluoroacetophenone derivatives SSP Co., Ltd. (JP) 2000-08-09 EP disclosed
US-6002028-A FUNGICIDES SS PHARMACEUTICAL CO., LTD. (JP) 1999-12-14 US disclosed
US-5986144-A Triazole derivative, preparation process thereof and pharmaceutical comprising the same as an effective ingredient SS PHARMACEUTICAL CO., LTD. (JP) 1999-11-16 US disclosed
US-5945438-A ANTIMYCOTIC AGENT SS PHARMACEUTICAL CO., LTD. (JP) 1999-08-31 US disclosed
EP-0780380-A1 Triazole derivatives with antimycotic action and intermediates SS PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed