SCHEMBL22640606

SCHEMBL22640606

C=C(/C=C\C)c1ccc(N(c2ccccc2)c2ccc(-c3ccccc3-c3ccccc3-c3ccc(N(c4ccccc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.34
▸ ALDH1A1 P00352 5/20 0.34
▸ HPGD P15428 2/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ EGFR P00533 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ AGTR1 P30556 1/20 0.33
▸ OXTR P30559 1/20 0.32
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 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
SCHEMBL23073559 0.84 EGFR (0.31) EGFR
SCHEMBL24556001 0.82 MAPT (0.36) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL24023059 0.79 MAPT (0.41) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL14681343 0.78 MAPT (0.36) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL17640447 0.78 MAPT (0.39) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL22995714 0.78 MAPT (0.39) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL15866018 0.77 ALDH1A1 (0.48) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL24313408 0.77 ALDH1A1 (0.48) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL16305441 0.77 ALDH1A1 (0.48) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL16305438 0.77 ALDH1A1 (0.48) MAPTALDH1A1HPGDSMN1; SMN2L3MBTL1

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-3244462-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2020-11-11 — — EP disclosed
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