SCHEMBL20032026

SCHEMBL20032026

CCN(C)Cn1nc(C(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 2/20 0.37
KDM4E B2RXH2 4/20 0.36
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.33
MPO P05164 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
TRPC3 Q13507 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 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
SCHEMBL769183 0.79 LMNA (0.41) GRIA2KDM4ELMNAL3MBTL1MPO
SCHEMBL20381740 0.73 CNR1 (0.47) GRIA2KDM4ELMNAL3MBTL1
SCHEMBL19214735 0.70 LMNA (0.35) GRIA2KDM4ELMNAL3MBTL1MPO
SCHEMBL18160626 0.70 LMNA (0.35) GRIA2KDM4ELMNAL3MBTL1MPO
SCHEMBL12859150 0.69 LMNA (0.39) GRIA2KDM4ELMNAL3MBTL1MPO
SCHEMBL21848996 0.69 GRN (0.36) GRIA2KDM4ELMNAMPOALDH1A1
SCHEMBL13169942 0.69 LMNA (0.46) GRIA2KDM4ELMNAL3MBTL1CYP1A2
SCHEMBL18979078 0.68 GRIA2 (0.37) GRIA2KDM4ELMNAL3MBTL1CYP1A2
SCHEMBL12871860 0.67 MPO (0.45) GRIA2KDM4ELMNAL3MBTL1MPO
SCHEMBL1834368 0.67 LMNA (0.47) KDM4ELMNAL3MBTL1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180094086-A1 NEAR INFRARED ABSORBING COMPOSITION, NEAR INFRARED CUT FILTER, METHOD OF MANUFACTURING NEAR INFRARED CUT FILTER, DEVICE, METHOD OF MANUFACTURING COPPER-CONTAINING POLYMER, AND COPPER-CONTAINING POLYMER FUJIFILM CORPORATION (JP) 2018-04-05 US disclosed