SCHEMBL10583174

SCHEMBL10583174

CCCC(=O)C(=O)CCCN(CC)c1cccc(C)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.54
▸ LMNA P02545 5/20 0.54
▸ USP2 O75604 2/20 0.54
▸ ALDH1A1 P00352 6/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ GFER P55789 3/20 0.47
▸ HTT P42858 5/20 0.47
▸ TP53 P04637 4/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ GPX4 P36969 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ ALOX15 P16050 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45

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
SCHEMBL9446163 0.86 MAPT (0.53) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL1250870 0.86 MAPT (0.53) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL10582546 0.84 CES2 (0.51) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL1252550 0.82 MAPT (0.50) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL8391459 0.82 ALDH1A1 (0.48) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL11146469 0.82 ALDH1A1 (0.50) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL10583176 0.81 ALDH1A1 (0.45) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL9651135 0.81 MAPT (0.46) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL28820283 0.81 MAPT (0.60) MAPTLMNAUSP2ALDH1A1MEN1
SCHEMBL397442 0.80 GFER (0.54) MAPTLMNAUSP2ALDH1A1MEN1

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-0297710-A1 Disperse dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-01-04 — — EP disclosed
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