SCHEMBL23435086

SCHEMBL23435086

C/C=C(\C=C/CC)N(c1ccccc1)c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.34
▸ MAPT P10636 3/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ APP P05067 1/20 0.33
▸ TRPM8 Q7Z2W7 2/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ KMT2A Q03164 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31

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
SCHEMBL18828278 0.88 — —
SCHEMBL20385009 0.86 TRPM8 (0.44) ALDH1A1CYP2C19TRPM8NPSR1KMT2A
SCHEMBL19720843 0.86 MAOB (0.37) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2
SCHEMBL20999115 0.86 ALDH1A1 (0.37) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2
SCHEMBL19705322 0.85 — —
SCHEMBL29320894 0.84 ALDH1A1 (0.36) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2
SCHEMBL16622856 0.84 MAOB (0.38) ALDH1A1MAPTL3MBTL1HPGDSMN1; SMN2
SCHEMBL23186649 0.82 TRPM8 (0.32) ALDH1A1TRPM8TSHR
SCHEMBL19836373 0.81 ALDH1A1 (0.33) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2
SCHEMBL19311819 0.80 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2

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-3828949-A1 ORGANIC LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2021-06-02 — — EP disclosed
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