SCHEMBL23925337

SCHEMBL23925337

CCCCCC1CCCC12NC(=O)C(C)N2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP1A2 P05177 3/20 0.31
PSMB11 A5LHX3 1/20 0.31
PSMA7 O14818 1/20 0.31
PSMB1 P20618 1/20 0.31
PSMA1 P25786 1/20 0.31
PSMA2 P25787 1/20 0.31
PSMA3 P25788 1/20 0.31
PSMA4 P25789 1/20 0.31
PSMB8 P28062 1/20 0.31
PSMB9 P28065 1/20 0.31
PSMA5 P28066 1/20 0.31
PSMB4 P28070 1/20 0.31
PSMB6 P28072 1/20 0.31
PSMB5 P28074 1/20 0.31
PSMB10 P40306 1/20 0.31
PSMB3 P49720 1/20 0.31
PSMB2 P49721 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
SCHEMBL27200246 1.00 TDP1 (0.47) TDP1ALDH1A1L3MBTL1CYP1A2PSMB11
SCHEMBL27200245 0.77 TDP1 (0.39) TDP1ALDH1A1MEN1KMT2A
SCHEMBL30188181 0.77 TDP1 (0.39) TDP1ALDH1A1MEN1KMT2A
SCHEMBL23925543 0.76 TDP1 (0.48) TDP1ALDH1A1L3MBTL1CYP1A2
SCHEMBL27200247 0.75 TDP1 (0.47) TDP1ALDH1A1L3MBTL1CYP1A2PSMB11
SCHEMBL27200254 0.75 TDP1 (0.47) TDP1ALDH1A1L3MBTL1CYP1A2PSMB11
SCHEMBL29851366 0.66 TDP1 (0.43) TDP1ALDH1A1L3MBTL1CYP1A2CCR2
SCHEMBL27200240 0.66 TDP1 (0.43) TDP1ALDH1A1L3MBTL1CYP1A2CCR2
SCHEMBL29851359 0.65 TDP1 (0.42) TDP1ALDH1A1L3MBTL1CYP1A2PSMB11
SCHEMBL17351007 0.64 TDP1 (0.43) TDP1ALDH1A1CYP1A2

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-4085052-A1 COMPOUNDS FOR PROVIDING A LONG-LASTING ODOR Firmenich SA (CH) 2022-11-09 EP disclosed
WO-2021209396-A1 COMPOUNDS FOR PROVIDING A LONG-LASTING ODOR FIRMENICH SA (CH) 2021-10-21 WO disclosed