SCHEMBL7840491

SCHEMBL7840491

COc1ccc(C=C2C(=O)C3CC2C2CCCC32)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.54
MAPT P10636 3/20 0.48
PLIN1 O60240 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
PLIN5 Q00G26 1/20 0.48
ABHD5 Q8WTS1 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 3/20 0.45
TSHR P16473 1/20 0.45
PDE4B Q07343 6/20 0.44
PIM1 P11309 1/20 0.44
PIM3 Q86V86 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
HPGD P15428 1/20 0.42
PDE3A Q14432 3/20 0.41

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
SCHEMBL7848942 0.83 KMT2A (0.51) NPC1MAPTKMT2AMEN1ALDH1A1
SCHEMBL7848281 0.78 NPC1 (0.42) NPC1MAPTLMNAGAAMAPK1
SCHEMBL7848396 0.75 MAPT (0.45) MAPTLMNAGAAALDH1A1PIM1
SCHEMBL29705880 0.70 NPC1 (1.00) NPC1MAPTPLIN1LMNAGAA
SCHEMBL31432748 0.69 MAPT (0.59) NPC1MAPTPLIN1LMNAGAA
SCHEMBL31432760 0.66 MAPT (0.88) NPC1MAPTPLIN1LMNAGAA
SCHEMBL31432701 0.66 MAPT (0.88) NPC1MAPTPLIN1LMNAGAA
SCHEMBL19050165 0.66 MAPT (0.88) NPC1MAPTPLIN1LMNAGAA
SCHEMBL7990683 0.66 KMT2A (0.54) NPC1MAPTPLIN1LMNAGAA
SCHEMBL9377078 0.66 ALDH1A1 (0.51) NPC1MAPTLMNATDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0754445-B1 Photostable cosmetic light screening compositions HOFFMANN LA ROCHE (CH) 2001-10-24 EP claimed
US-5840282-A SUNSCREEN AGENTS; BENZYLIDENE-TYPE STABILIZER GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) 1998-11-24 US claimed
EP-0754445-A2 Photostable cosmetic light screening compositions GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1997-01-22 EP claimed
EP-0754445-B1 Photostable cosmetic light screening compositions HOFFMANN LA ROCHE (CH) 2001-10-24 EP disclosed
EP-0754445-A2 Photostable cosmetic light screening compositions GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1997-01-22 EP disclosed