SCHEMBL7848396

SCHEMBL7848396

O=C1/C(=C/c2ccccc2)C2CC1C1CCCC21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
HPGD P15428 2/20 0.45
CYP1A2 P05177 4/20 0.43
CYP2D6 P10635 2/20 0.43
CYP2C19 P33261 2/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
F3 P13726 1/20 0.39
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
DUSP1 P28562 1/20 0.38
DUSP6 Q16828 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
HIF1A Q16665 1/20 0.38
ALDH1A1 P00352 3/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL7848283 1.00 MAPT (0.45) MAPTHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL14080309 0.92 MAPT (0.36) MAPTHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL13299357 0.79 NPC1 (0.37) MAPTHPGDSMN1; SMN2ALDH1A1
SCHEMBL7848281 0.76 NPC1 (0.42) MAPTHPGDLMNASMN1; SMN2ALDH1A1
SCHEMBL7840491 0.75 NPC1 (0.54) MAPTHPGDLMNAALDH1A1HTT
SCHEMBL8304457 0.70 PRSS1 (0.31) F2PRSS1
SCHEMBL94584 0.69 CYP1A2 (0.47) MAPTHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL4665877 0.69 CYP1A2 (0.47) MAPTHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL3438541 0.67 MAPT (0.59) MAPTHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL5611750 0.67 MAPT (0.59) MAPTHPGDCYP1A2CYP2D6CYP2C19

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