SCHEMBL19985905

SCHEMBL19985905

c1cc(-c2ccc3ccccc3c2)cc(-n2c3ccccc3c3c4c5ccccc5c5ccccc5c4c4c5ccccc5sc4c32)c1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
S1PR4 O95977 2/20 0.32
S1PR5 Q9H228 2/20 0.32
TP53 P04637 1/20 0.32
PMM2 O15305 1/20 0.30
MPI P34949 1/20 0.30
PHOSPHO1 Q8TCT1 1/20 0.30
ALOX5 P09917 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
SCHEMBL22960406 0.94 MAPT (0.34) MAPTRXFP1HSD17B1HSD17B2S1PR4
SCHEMBL19985931 0.94 MAPT (0.33) MAPTRXFP1TP53
SCHEMBL19985923 0.93 MAPT (0.33) MAPTRXFP1TP53
SCHEMBL19985939 0.91 PMM2 (0.34) RXFP1S1PR4S1PR5TP53PMM2
SCHEMBL19985920 0.91 MAPT (0.36) MAPTRXFP1TP53ALOX5
SCHEMBL19985932 0.90 MAPT (0.35) MAPTRXFP1TP53ALOX5
SCHEMBL19985937 0.90 MAPT (0.37) MAPTRXFP1TP53ALOX5
SCHEMBL19985938 0.89 MAPT (0.36) MAPTRXFP1TP53
SCHEMBL19985921 0.89 PMM2 (0.39) MAPTRXFP1TP53PMM2MPI
SCHEMBL19986003 0.88 MAPT (0.34) MAPTRXFP1TP53ALOX5

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
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed