SCHEMBL9399044

SCHEMBL9399044

CC(=O)c1ccc(C(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.41
GABBR1 Q9UBS5 1/20 0.41
MAPT P10636 3/20 0.39
HPGD P15428 2/20 0.39
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
KIF11 P52732 1/20 0.39
HSD17B1 P14061 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
MAOB P27338 1/20 0.36
GRM8 O00222 1/20 0.36
GRM4 Q14833 1/20 0.36
MAPK1 P28482 1/20 0.36
NOS3 P29474 1/20 0.36
NOS1 P29475 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
SCHEMBL9449291 0.91 MAPT (0.58) GABBR2GABBR1MAPTHPGDLMNA
SCHEMBL4368257 0.83 TSHR (0.46) HPGDSMN1; SMN2CA1CA2
SCHEMBL9840099 0.81 TSHR (0.42) MAPTL3MBTL1KMT2ACA1CA2
Hydrochloric Acid SCHEMBL28483240 0.81 TSHR (0.44) HPGDSMN1; SMN2CA1CA2
SCHEMBL10355954 0.81 ALDH1A1 (0.36) GABBR2GABBR1CA2CES2CES1
SCHEMBL22159396 0.79 ESR1 (0.38)
SCHEMBL28666307 0.77 LMNA (0.47) MAPTLMNAKMT2ASMN1; SMN2POLB
SCHEMBL3313610 0.76 MAPT (0.48) MAPTHPGDLMNAL3MBTL1RAB9A
SCHEMBL8462292 0.74 ESR1 (0.54) MAPTHPGDLMNARAB9AKMT2A
SCHEMBL320072 0.74 ESR1 (0.54) MAPTHPGDLMNARAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115475541-A Poly (quinoline) film 恩特格里斯公司 2022-12-16 CN disclosed
US-5344981-A Fluorinated monomers useful for preparing fluorinated polyquinoline polymers MAXDEM INCORPORATED (US) 1994-09-06 US disclosed
EP-0543950-A4 FLUORINATED QUINOLINE POLYMERS AND THE CORRESPONDING FLUORINATED MONOMERS 1993-10-27 EP disclosed
EP-0543950-A1 FLUORINATED QUINOLINE POLYMERS AND THE CORRESPONDING FLUORINATED MONOMERS HITACHI CHEMICAL CO., LTD. (JP) 1993-06-02 EP disclosed
WO-1992003488-A1 FLUORINATED QUINOLINE POLYMERS AND THE CORRESPONDING FLUORINATED MONOMERS MAXDEM INCORPORATED (US) 1992-03-05 WO disclosed