SCHEMBL19985926

SCHEMBL19985926

c1ccc2c(c1)oc1ccc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6sc5c43)cc12

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
ESR2 Q92731 2/20 0.32
ESR1 P03372 1/20 0.32
AHR P35869 1/20 0.31
TP53 P04637 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
LMNA P02545 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
SCHEMBL17405705 0.94 MAPT (0.35) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17405417 0.94 MAPT (0.35) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17228965 0.94 MAPT (0.35) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL19985947 0.93 ESR2 (0.36) MAPTKDM4EMEN1ALDH1A1HPGD
SCHEMBL19985975 0.91 KDM4E (0.32) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17406037 0.91 KDM4E (0.33) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17405808 0.91 KDM4E (0.33) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17405840 0.91 MAPT (0.35) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17405557 0.90 ESR2 (0.35) MAPTSMN1; SMN2KDM4EMEN1NPC1
SCHEMBL17405495 0.90 KDM4E (0.34) MAPTSMN1; SMN2KDM4EMEN1NPC1

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