SCHEMBL1576591

SCHEMBL1576591

CCCCCC(=O)OC1(OC)C=CC(C=CC(=O)c2ccccc2)=C(O)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 2/20 0.39
TUBB P07437 2/20 0.39
TUBA3C P0DPH7 2/20 0.39
TUBA1B P68363 2/20 0.39
TUBA4A P68366 2/20 0.39
TUBB4B P68371 2/20 0.39
TUBB3 Q13509 2/20 0.39
TUBB2A Q13885 2/20 0.39
TUBB8 Q3ZCM7 2/20 0.39
TUBA3E Q6PEY2 2/20 0.39
TUBA1A Q71U36 2/20 0.39
TUBA1C Q9BQE3 2/20 0.39
TUBB6 Q9BUF5 2/20 0.39
TUBB2B Q9BVA1 2/20 0.39
TUBB1 Q9H4B7 2/20 0.39
AKT1 P31749 2/20 0.37
MAPT P10636 4/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL27762378 0.85 MAPT (0.44) AKT1MAPTNPC1RAB9AKMT2A
SCHEMBL1576393 0.76 BCHE (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6534548 0.75 MAPT (0.43) AKT1MAPTNPC1RAB9AKMT2A
SCHEMBL27929731 0.73 MAPT (0.38) AKT1MAPTNPC1RAB9AKMT2A
SCHEMBL7008154 0.73 PTPN1 (0.42) MAPTNPC1RAB9AKMT2ABCHE
SCHEMBL29945646 0.71 MAPT (0.46) MAPTNPC1RAB9AKMT2ABCHE
SCHEMBL6270921 0.71 MAPT (0.46) MAPTNPC1RAB9AKMT2ABCHE
SCHEMBL28010219 0.69 RECQL (0.43) MAPTNPC1RAB9AKMT2ABCHE
SCHEMBL30385151 0.69 RECQL (0.43) MAPTNPC1RAB9AKMT2ABCHE
SCHEMBL28010921 0.69 MAOB (0.43) AKT1MAPTNPC1RAB9AKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2482793-A1 USE OF PIPERIDINE ESTER DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'Oréal (FR) 2012-08-08 EP disclosed
EP-2482791-A1 USE OF CAPROLACTAM DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'Oréal (FR) 2012-08-08 EP disclosed
WO-2011038778-A1 USE OF CAPROLACTAM DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2011-04-07 WO disclosed
WO-2011038776-A1 USE OF PIPERIDINE ESTER DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2011-04-07 WO disclosed