SCHEMBL19986085

SCHEMBL19986085

c1ccc2c(c1)oc1cc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6oc5c43)ccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.38
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
ALDH1A1 P00352 6/20 0.37
MAPT P10636 5/20 0.37
KDM4E B2RXH2 5/20 0.37
HPGD P15428 4/20 0.37
PTGER4 P35408 1/20 0.36
LMNA P02545 2/20 0.33
PPARG P37231 2/20 0.33
RXFP1 Q9HBX9 2/20 0.33
NR2E3 Q9Y5X4 2/20 0.33
NCOR2 Q9Y618 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAOA P21397 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 3/20 0.32

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
SCHEMBL19986052 0.92 ALDH1A1 (0.38) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL17246253 0.92 AHR (0.40) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL19986058 0.92 RXFP1 (0.34) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL19986077 0.90 NPC1 (0.35) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL20311948 0.89 AHR (0.41) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL19986064 0.88 AHR (0.33) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL19997971 0.88 KDM4E (0.40) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL17246255 0.87 AHR (0.38) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL17405651 0.87 RXFP1 (0.34) AHRMEN1KMT2AALDH1A1MAPT
SCHEMBL19986068 0.87 KDM4E (0.43) MEN1KMT2AALDH1A1KDM4EHPGD

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