SCHEMBL19789616

SCHEMBL19789616

CC1C=CC(NCc2ccccc2)=CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.41
HTT P42858 1/20 0.39
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
GRIN2B Q13224 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HSD17B10 Q99714 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
FUCA1 P04066 2/20 0.35
FABP1 P07148 1/20 0.34
FABP6 P51161 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
MEN1 O00255 1/20 0.34
APEX1 P27695 1/20 0.34
KMT2A Q03164 1/20 0.34
ACHE P22303 1/20 0.34

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
SCHEMBL22725586 0.78 MAOA (0.46) HTTKDM4ECYP3A4MAPTHSD17B10
SCHEMBL22620525 0.69 ALDH1A1 (0.40) MAPTHSD17B10ACHE
SCHEMBL21086627 0.69 LDHA (0.32) HTT
SCHEMBL22084649 0.67 IDO1 (0.36) HTTPOLBMAPTCA1CA2
SCHEMBL19942833 0.66 ALDH1A1 (0.36) GLAHTTPOLBCYP3A4MAPT
SCHEMBL21594268 0.66 SLC6A2 (0.41) CYP3A4SIGMAR1MEN1KMT2A
SCHEMBL14240581 0.65
SCHEMBL3374310 0.64 POLB (0.48) HTTPOLBKDM4ECYP3A4MAPT
SCHEMBL9630573 0.64 POLB (0.53) HTTPOLBKDM4ECYP3A4MAPT
SCHEMBL21342307 0.63 HPGD (0.38) KDM4ECYP3A4MAPTHSD17B10MEN1

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
EP-3273498-A1 COMPOSITION FOR FORMING HOLE COLLECTING LAYER OF PHOTOSENSOR ELEMENT, AND PHOTOSENSOR ELEMENT Nissan Chemical Industries, Ltd. (JP) 2018-01-24 EP disclosed