SCHEMBL19986135

SCHEMBL19986135

c1ccc(-c2nc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6oc5c43)nc3c2sc2ccccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.32
MEN1 O00255 1/20 0.32
CSF1R P07333 1/20 0.32
PDGFRB P09619 1/20 0.32
MAPT P10636 1/20 0.32
KIT P10721 1/20 0.32
FLT3 P36888 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL19986138 0.98 PTGER1 (0.32) PTGER1MEN1CSF1RPDGFRBMAPT
SCHEMBL21913814 0.95 PTGER1 (0.33) PTGER1MEN1CSF1RPDGFRBMAPT
SCHEMBL19986137 0.94 ESR1 (0.30) ESR1ESR2
SCHEMBL22199997 0.93 PTGER1 (0.32) PTGER1MEN1CSF1RPDGFRBMAPT
SCHEMBL22708357 0.87 ESR2 (0.33) ESR1ESR2
SCHEMBL22708821 0.87 LIMK1 (0.34) ESR1ESR2
SCHEMBL22708619 0.87 LIMK1 (0.34) ESR1ESR2
SCHEMBL22708360 0.87 ESR2 (0.33) ESR1ESR2
SCHEMBL22708657 0.87 LIMK1 (0.32) PTGER1MEN1CSF1RPDGFRBMAPT
SCHEMBL19046689 0.87 TNKS (0.32) MEN1MAPTKMT2A

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