SCHEMBL9358658

SCHEMBL9358658

CN1C(C)(C)CC(O)C(CC2CCCCC2)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
MGAM O43451 1/20 0.31
SI P14410 1/20 0.31
GLB1 P16278 1/20 0.30
GBA1 P04062 2/20 0.30
UGCG Q16739 2/20 0.30
GBA2 Q9HCG7 2/20 0.30

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
SCHEMBL9362506 0.86
SCHEMBL9358221 0.82 LIPA (0.31)
SCHEMBL9358381 0.80 CA1 (0.32)
SCHEMBL9358439 0.79 ALDH1A1 (0.34) ALDH1A1CYP3A4MAPK1
SCHEMBL9358721 0.78
SCHEMBL9358238 0.76 KMT2A (0.32) ALDH1A1
SCHEMBL9358198 0.74 CYP3A4 (0.41) ALDH1A1CYP3A4
SCHEMBL9358632 0.74 CHRM2 (0.38) ALDH1A1
SCHEMBL9358594 0.72 NAAA (0.40)
SCHEMBL9358519 0.70 CHRM2 (0.34)

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