SCHEMBL28820283

SCHEMBL28820283

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

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.60
▸ ALDH1A1 P00352 5/20 0.59
▸ HTT P42858 4/20 0.59
▸ LMNA P02545 5/20 0.58
▸ ALOX15 P16050 2/20 0.58
▸ KMT2A Q03164 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ USP2 O75604 2/20 0.55
▸ NPSR1 Q6W5P4 2/20 0.55
▸ TP53 P04637 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ THRB P10828 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ GAA P10253 1/20 0.53

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
SCHEMBL9060635 0.86 GFER (0.57) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL28820276 0.82 NR3C1 (0.47) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL10583174 0.81 MAPT (0.54) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL9651135 0.78 MAPT (0.46) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL1250870 0.78 MAPT (0.53) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL9446163 0.78 MAPT (0.53) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL397442 0.77 GFER (0.54) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL10687077 0.77 ALDH1A1 (0.56) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL8391459 0.77 ALDH1A1 (0.48) MAPTALDH1A1HTTLMNAALOX15
SCHEMBL11146469 0.77 ALDH1A1 (0.50) MAPTALDH1A1HTTLMNAALOX15

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
CN-114773289-A Nitrobenzoisothiazole azo compound and application thereof 辽宁庸信达染料化工有限公司 2022-07-22 — — CN disclosed
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