SCHEMBL9489504

SCHEMBL9489504

COC(C)CCOc1ccc(C=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HPGD P15428 2/20 0.54
LMNA P02545 2/20 0.54
ALDH1A3 P47895 1/20 0.50
CYP2A6 P11509 1/20 0.50
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 1/20 0.42
TYR P14679 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 1/20 0.41
KDM4E B2RXH2 1/20 0.41
FDPS P14324 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL13556994 0.86 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL11390540 0.86 ALDH1A1 (0.54) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL8371512 0.86 ALDH1A1 (0.57) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL7079626 0.86 TDP1 (0.59) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL21104599 0.83 ALDH1A1 (0.54) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL21104611 0.83 ALDH1A1 (0.54) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL3068736 0.81 TDP1 (0.54) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL11383524 0.81 ALDH1A1 (0.57) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL19018472 0.81 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2HPGDLMNA
SCHEMBL13874349 0.80 DRD2 (0.47) MAPTSMN1; SMN2HPGDLMNATDP1

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-0368717-B1 5-BENZYLIDENE 3-OXA CYCLOPENTANONE DERIVATIVES, PROCESS FOR THEIR MANUFACTURE AND THEIR USE IN COSMETIC COMPOSITIONS TO PROTECT THE SKIN AND THE HAIR AGAINST SUN RADIATION L'OREAL (FR) 1993-01-20 EP disclosed
EP-0368717-A1 5-Benzylidene 3-oxa cyclopentanone derivatives, process for their manufacture and their use in cosmetic compositions to protect the skin and the hair against sun radiation L'OREAL (FR) 1990-05-16 EP disclosed