SCHEMBL20168980

SCHEMBL20168980

C=N/C(C)=C(\C=C/C)c1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ RAB9A P51151 7/20 0.37
▸ NPC1 O15118 4/20 0.37
▸ GAA P10253 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ LMNA P02545 3/20 0.37
▸ NAPRT Q6XQN6 1/20 0.37
▸ P4HTM Q9NXG6 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ OPRK1 P41145 3/20 0.36
▸ TDP1 Q9NUW8 3/20 0.36
▸ HTT P42858 2/20 0.36
▸ PTBP1 P26599 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ PKM P14618 2/20 0.36
▸ TOP2A P11388 1/20 0.36

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
SCHEMBL25455561 0.79 ALDH1A1 (0.44) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL20168971 0.73 KDM4E (0.42) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL21953560 0.73 KDM4E (0.48) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL18413039 0.73 ALDH1A1 (0.47) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL20669969 0.72 L3MBTL1 (0.37) KDM4EALDH1A1NAPRTL3MBTL1SMN1; SMN2
SCHEMBL3729714 0.72 ALDH1A1 (0.59) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL9160142 0.72 ALDH1A1 (0.59) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL3729713 0.72 ALDH1A1 (0.59) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL23001343 0.70 KDM4E (0.46) KDM4EALDH1A1CES2CES1RAB9A
SCHEMBL22754517 0.70 ALDH1A1 (0.44) KDM4EALDH1A1CES2CES1RAB9A

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
US-9978961-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-05-22 — — US disclosed
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