SCHEMBL9623288

SCHEMBL9623288

C=CCc1ccc(C=C(C(=O)OCC)C(=O)OCC)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.64
KMT2A Q03164 7/20 0.64
MAPT P10636 10/20 0.63
LMNA P02545 5/20 0.63
NPSR1 Q6W5P4 3/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
S1PR4 O95977 1/20 0.63
S1PR1 P21453 1/20 0.63
MAPK1 P28482 1/20 0.63
NR1H4 Q96RI1 1/20 0.56
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HSP90AA1 P07900 2/20 0.50
MITF O75030 1/20 0.50
HTT P42858 1/20 0.50
HPGD P15428 1/20 0.46
PLIN1 O60240 1/20 0.44

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
SCHEMBL1068265 0.85 MEN1 (0.85) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL14354769 0.83 MEN1 (0.70) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL9623198 0.81 MEN1 (0.62) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL15095092 0.80 MEN1 (0.77) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL540859 0.79 NR1H4 (0.64) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL9623693 0.79 MEN1 (0.52) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL435677 0.79 KMT2A (0.74) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL935186 0.79 MEN1 (1.00) MEN1KMT2AMAPTLMNANPSR1
Benzene SCHEMBL27988126 0.79 MEN1 (1.00) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL2318131 0.78 MEN1 (0.68) MEN1KMT2AMAPTLMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5175340-A Sunscreen agents, stabilizers L'OREAL (FR) 1992-12-29 US claimed
EP-0350386-B1 UNSATURATED DERIVATIVES OF LIPID SOLUBLE BENZAL MALONATES, AND THEIR USE AS UV ABSORBERS IN THE COSMETIC FIELD L'OREAL (FR) 1992-04-08 EP claimed
US-5175340-A Sunscreen agents, stabilizers L'OREAL (FR) 1992-12-29 US disclosed