SCHEMBL9898752

SCHEMBL9898752

CON=C1C=C(C(C)(C)C)C=C(C(C)(C)C)C1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPT P10636 2/20 0.53
CES2 O00748 1/20 0.53
PKM P14618 1/20 0.53
HPGD P15428 1/20 0.53
CES1 P23141 1/20 0.53
MPI P34949 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MCL1 Q07820 1/20 0.34
NPC1 O15118 1/20 0.32
KMT2A Q03164 1/20 0.32
GPR35 Q9HC97 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL9898611 0.81 ALDH1A1 (0.49) ATMALDH1A1MAPTCES2PKM
SCHEMBL9899177 0.80 ALDH1A1 (0.47) ATMALDH1A1MAPTCES2PKM
SCHEMBL22080461 0.78 ALDH1A1 (0.57) ATMALDH1A1MAPTCES2PKM
SCHEMBL22080994 0.78 ALDH1A1 (0.57) ATMALDH1A1MAPTCES2PKM
SCHEMBL15440572 0.75 ALDH1A1 (0.53) ATMALDH1A1MAPTCES2PKM
SCHEMBL9899601 0.75 ALDH1A1 (0.52) ATMALDH1A1MAPTCES2PKM
SCHEMBL9898853 0.75 ALDH1A1 (0.41) ATMALDH1A1MAPTCES2PKM
SCHEMBL15440222 0.71 ALDH1A1 (0.49) ATMALDH1A1MAPTCES2PKM
SCHEMBL15439836 0.71 ALDH1A1 (0.49) ATMALDH1A1MAPTCES2PKM
SCHEMBL15439767 0.70 ALDH1A1 (0.47) ATMALDH1A1MAPTCES2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748531-B2 Polymers functionalized with oxime compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2014-06-10 US claimed
US-20120149833-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 US claimed
CN-103282386-B Polymers functionalized with oxime compounds containing acyl groups BRIDGESTONE CORP 2015-07-22 CN disclosed
EP-2649102-B1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORP (JP) 2014-11-26 EP disclosed
US-8748531-B2 Polymers functionalized with oxime compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2014-06-10 US disclosed
EP-2649102-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP Bridgestone Corporation (JP) 2013-10-16 EP disclosed
US-20120149833-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 US disclosed
WO-2012078962-A1 POLYMERS FUNCTIONALIZED WITH OXIME COMPOUNDS CONTAINING AN ACYL GROUP BRIDGESTONE CORPORATION (JP) 2012-06-14 WO disclosed