SCHEMBL7904447

SCHEMBL7904447

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.52
TGM2 P21980 3/20 0.52
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
GSTO1 P78417 1/20 0.41
CES1 P23141 3/20 0.40
ALOX15 P16050 2/20 0.40
MAPK1 P28482 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CES2 O00748 2/20 0.39
TSHR P16473 2/20 0.39
DAO P14920 1/20 0.39

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
SCHEMBL2931801 0.82 AKT1 (0.54) AKT1TGM2ALDH1A1ALOX15HPGD
SCHEMBL7902371 0.78 ALDH1A1 (0.46) AKT1TGM2ALDH1A1CYP3A4CES1
SCHEMBL28387684 0.77 TGM2 (0.48) AKT1TGM2ALDH1A1CYP3A4CYP2C9
SCHEMBL8840278 0.72 RAB9A (0.57) AKT1TGM2ALDH1A1CYP2C9ALOX15
SCHEMBL15979119 0.72 ALDH1A1 (0.44) AKT1TGM2ALDH1A1CYP3A4CYP2C9
SCHEMBL3491749 0.72 RAB9A (0.56) TGM2ALDH1A1TDP1HPGDMEN1
SCHEMBL14837692 0.71 TGM2 (0.50) AKT1TGM2ALDH1A1CYP3A4CYP2C9
O-Xylene SCHEMBL11054792 0.71 TGM2 (0.50) AKT1TGM2ALDH1A1CYP3A4CYP2C9
SCHEMBL8743154 0.71 TGM2 (0.71) TGM2MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL28375941 0.69 AKT1 (0.54) AKT1TGM2ALDH1A1ALOX15HPGD

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