SCHEMBL20168971

SCHEMBL20168971

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ LMNA P02545 4/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ NAPRT Q6XQN6 1/20 0.38
▸ P4HTM Q9NXG6 1/20 0.38
▸ RAB9A P51151 7/20 0.37
▸ NPC1 O15118 6/20 0.37
▸ PKM P14618 4/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KRAS P01116 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ HTT P42858 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL18682742 0.79 ALDH1A1 (0.42) KDM4EALDH1A1CES2CES1LMNA
SCHEMBL19085493 0.77 ALDH1A1 (0.43) KDM4EALDH1A1CES2CES1LMNA
SCHEMBL18738968 0.76 ADRA2A (0.33) RAB9AMAPTTDP1
SCHEMBL23343244 0.76 KDM4E (0.52) KDM4EALDH1A1CES2CES1LMNA
SCHEMBL19170427 0.75 P2RX7 (0.40) —
SCHEMBL23001343 0.75 KDM4E (0.46) KDM4EALDH1A1CES2CES1LMNA
SCHEMBL18789868 0.74 KDM4E (0.46) KDM4EALDH1A1CES2CES1LMNA
SCHEMBL18413039 0.74 ALDH1A1 (0.47) KDM4EALDH1A1CES2CES1LMNA
SCHEMBL18905315 0.74 ATM (0.35) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL21279982 0.74 KMT2A (0.42) KDM4EALDH1A1CES2CES1LMNA

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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