SCHEMBL19954739

SCHEMBL19954739

C=CC(=C)Nc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.56
▸ GAA P10253 3/20 0.56
▸ MEN1 O00255 4/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ NPC1 O15118 3/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ MAPT P10636 4/20 0.50
▸ GRIN2D O15399 1/20 0.47
▸ GRIN3B O60391 1/20 0.47
▸ GRIN1 Q05586 1/20 0.47
▸ GRIN2A Q12879 1/20 0.47
▸ GRIN2B Q13224 1/20 0.47
▸ GRIN2C Q14957 1/20 0.47
▸ GRIN3A Q8TCU5 1/20 0.47
▸ SIGMAR1 Q99720 1/20 0.47

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
SCHEMBL24374384 0.82 KDM4E (0.50) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL29591698 0.81 KDM4E (0.62) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL647157 0.81 KDM4E (0.62) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL24004141 0.80 GAA (0.51) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL11841292 0.78 KDM4E (0.69) KDM4EGAAMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL11840818 0.77 KDM4E (0.67) KDM4EGAAMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL6018236 0.77 KDM4E (0.67) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL27870124 0.76 KDM4E (0.59) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL1273874 0.75 KDM4E (0.64) KDM4EGAAMEN1KMT2ANPC1
SCHEMBL24766141 0.75 KMT2A (0.55) KDM4EGAAMEN1KMT2ANPC1

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-20210351358-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2021-11-11 — — US disclosed
US-9917273-B2 Cross-linking polymer and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-03-13 — — US disclosed
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