SCHEMBL9358356

SCHEMBL9358356

Cc1ccccc1CC1C(O)CC(C)(C)N(C)C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
DRD2 P14416 2/20 0.36
DRD1 P21728 2/20 0.36
GRIN2B Q13224 2/20 0.35
ACHE P22303 1/20 0.33
DRD4 P21917 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 2/20 0.32
RAB9A P51151 1/20 0.32
CES2 O00748 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
CYP2A13 Q16696 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
SCHEMBL9358209 0.81 LMNA (0.38) GBA1ALOX15KMT2AMEN1
SCHEMBL9358391 0.77 TRPA1 (0.40) GBA1GRIN2BGAA
SCHEMBL9362686 0.73 ALOX15 (0.52) GBA1CYP2D6SLC6A2SLC6A4DRD2
SCHEMBL11145337 0.72 LMNA (0.35) ALOX15
SCHEMBL9358293 0.71 ALDH1A1 (0.36) ALOX15KMT2AMEN1
SCHEMBL9358363 0.71 NR1H4 (0.35)
SCHEMBL10582848 0.66 GAA (0.38) GAA
SCHEMBL9362699 0.63 ALDH1A1 (0.44) ALOX15KMT2AMEN1
SCHEMBL9039574 0.63 KMT2A (0.41) GBA1GRIN2BACHEKMT2ACYP2A13
SCHEMBL9358658 0.63 ALDH1A1 (0.32) GBA1

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-0518197-B1 Piperidine derivatives MITSUBISHI PETROCHEMICAL CO (JP) 1994-12-21 EP disclosed
US-5260443-A For polyolefin films MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1993-11-09 US disclosed
US-5189172-A Useful as photostabilizer or as intermediates for pharmaceuticals and agricultural chemicals MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1993-02-23 US disclosed
EP-0518197-A1 Piperidine derivatives Mitsubishi Chemical Corporation (JP) 1992-12-16 EP disclosed