SCHEMBL7902371

SCHEMBL7902371

C=C[C](NC(=O)C(=C)C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 4/20 0.46
AKT1 P31749 1/20 0.46
TDP1 Q9NUW8 2/20 0.42
MAPT P10636 5/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
XBP1 P17861 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 1/20 0.40
CES1 P23141 2/20 0.38
CES2 O00748 1/20 0.38
ELANE P08246 1/20 0.38
TGM2 P21980 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 1/20 0.38
GLA P06280 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
SCHEMBL194548 0.78 ALDH1A1 (0.52) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
SCHEMBL27773578 0.78 ALDH1A1 (0.52) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
SCHEMBL7904447 0.78 AKT1 (0.52) ALDH1A1KDM4EAKT1TDP1MAPT
SCHEMBL10408109 0.77 CES2 (0.52) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
Methacrylic Acid SCHEMBL9818374 0.71 AKT1 (0.76) ALDH1A1KDM4EAKT1TDP1MAPT
SCHEMBL4808691 0.70 ALDH1A1 (0.56) ALDH1A1KDM4ETDP1SMN1; SMN2LMNA
Acrylic Acid SCHEMBL5700152 0.70 AKT1 (0.56) ALDH1A1KDM4EAKT1TDP1MAPT
Benzoic Acid SCHEMBL29235876 0.70 TSHR (0.61) ALDH1A1AKT1TDP1MAPTSMN1; SMN2
Acetone SCHEMBL10909688 0.70 AKT1 (0.56) ALDH1A1AKT1TDP1MAPTSMN1; SMN2
Acetophenone SCHEMBL29257253 0.69 TDP1 (0.54) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5939053-A TITANIUM, ZINC, CERIUM, ZIRCONIUM AND IRON OXIDES L'OREAL (FR) 1999-08-17 US claimed
US-5776440-A METAL OXIDES AND POLYMERS L'OREAL (FR) 1998-07-07 US claimed
EP-0601080-B1 FILTERING COSMETIC COMPOSITION CONTAINING A LIPOSOLUBLE FILTER POLYMER WITH HYDROCARBONATED STRUCTURE AND A FILTER SILICONE OREAL (FR) 1995-07-26 EP claimed
EP-0555460-B1 FILTERING COSMETIC COMPOSITION COMPRISING A NANOPIGMENT OF METAL OXIDE AND A LIPOSOLUBLE FILTER POLYMER OREAL (FR) 1995-05-31 EP claimed
US-6183728-B1 POLYSILOXANE GRAFTED WITH MOLECULES CONTAINING 2-(2*-HYDROXYPHENYL)BENZOTRIAZOLE RESIDUES L'OREAL (FR) 2001-02-06 US disclosed
US-5939053-A TITANIUM, ZINC, CERIUM, ZIRCONIUM AND IRON OXIDES L'OREAL (FR) 1999-08-17 US disclosed
US-5863522-A CONTAINING BENZYLIDENECAMPHOR, OR BENZOTRIAZOLE, OR DIBENZOYLMETHANE RESIDUE-CONTAINING POLYSILOXANE L'OREAL (FR) 1999-01-26 US disclosed
US-5776440-A METAL OXIDES AND POLYMERS L'OREAL (FR) 1998-07-07 US disclosed
US-5733895-A SUNSCREEN AGENTS FOR SKIN AND HAIR L'OREAL (FR) 1998-03-31 US disclosed