SCHEMBL20662933

SCHEMBL20662933

C=C/C(=C\c1c(C)c2ccccc2n1-c1ccccc1)c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ATM Q13315 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ AKR1C4 P17516 1/20 0.34
▸ AKR1C3 P42330 1/20 0.34
▸ AKR1C2 P52895 1/20 0.34
▸ AKR1C1 Q04828 1/20 0.34
▸ RORC P51449 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ RXFP1 Q9HBX9 3/20 0.33
▸ PLA2G2A P14555 1/20 0.33
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ ALDH1A1 P00352 2/20 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
SCHEMBL26310269 0.76 KDM4E (0.52) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL23812751 0.72 RORC (0.38) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL18436869 0.72 KDM4E (0.46) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL22751751 0.71 L3MBTL1 (0.48) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL22133343 0.70 KDM4E (0.45) HTTL3MBTL1KDM4EATMRORC
SCHEMBL22408862 0.70 KDM4E (0.42) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL24631962 0.69 RORC (0.34) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL20692453 0.69 KDM4E (0.50) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL18588367 0.69 KDM4E (0.50) MAPTLMNAHTTL3MBTL1KDM4E
SCHEMBL20990859 0.69 KDM4E (0.50) MAPTLMNAHTTL3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3431476-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFROM Duk San Neolux Co., Ltd. (KR) 2019-01-23 — — EP disclosed
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