SCHEMBL9168728

SCHEMBL9168728

C(=Cc1cccc2ccccc12)c1ccc(C=Cc2cccc3ccccc23)cc1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHAT P28329 5/20 0.70
PTGS1 P23219 1/20 0.61
PTGS2 P35354 1/20 0.61
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55

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
SCHEMBL9168725 1.00 CHAT (0.70) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL1782982 0.93 CHAT (0.68) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL29794070 0.93 CHAT (0.68) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL2774767 0.93 CHAT (0.68) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL6051064 0.93 CHAT (0.68) CHATPTGS1PTGS2HDAC8HDAC6
Benzene SCHEMBL28841289 0.93 CHAT (0.68) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL10706694 0.91 CHAT (0.62) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL10706700 0.91 CHAT (0.62) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL10706687 0.91 CHAT (0.62) CHATPTGS1PTGS2HDAC8HDAC6
SCHEMBL10128974 0.90 CHAT (0.60) CHATPTGS1PTGS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0373582-B1 Electroluminescence device IDEMITSU KOSAN CO (JP) 1995-03-01 EP disclosed
US-5121029-A Displays high brightness by applying low voltage IDEMITSU KOSAN CO., LTD. (JP) 1992-06-09 US disclosed
EP-0373582-A1 Electroluminescence device IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-06-20 EP disclosed