SCHEMBL15020051

SCHEMBL15020051

CCCC1=C(N)C(=Nc2ccc(N(CC)C(C)C)cc2)C=C(Nc2ccc(N(CC)C(C)C)cc2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ P2RX3 P56373 2/20 0.31
▸ MCL1 Q07820 2/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL15020050 1.00 ALDH1A1 (0.33) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15020327 0.88 L3MBTL1 (0.34) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15020326 0.88 L3MBTL1 (0.34) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL17253312 0.83 ALDH1A1 (0.35) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15019824 0.81 ALDH1A1 (0.35) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15020144 0.81 ALDH1A1 (0.35) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15039492 0.81 ALDH1A1 (0.35) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15020128 0.79 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL15020129 0.79 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTLMNAHTT
SCHEMBL17253269 0.79 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTLMNAHTT

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
EP-2791252-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE L'OREAL (FR) 2014-10-22 — — EP disclosed
WO-2013087768-A1 TRIAROMATIC AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, METHOD OF IMPLEMENTATION AND USE L'OREAL (FR) 2013-06-20 — — WO disclosed
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