SCHEMBL6924253

SCHEMBL6924253

CCOC(=O)C(=Cc1ccc(N)cc1)C(=O)OCC

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.72
KMT2A Q03164 7/20 0.72
MAPT P10636 9/20 0.71
LMNA P02545 4/20 0.71
NPSR1 Q6W5P4 2/20 0.71
CYP1A2 P05177 2/20 0.71
CYP2C9 P11712 1/20 0.71
CYP2C19 P33261 1/20 0.71
S1PR4 O95977 1/20 0.71
S1PR1 P21453 1/20 0.71
MAPK1 P28482 1/20 0.71
NR1H4 Q96RI1 1/20 0.57
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HSP90AA1 P07900 2/20 0.55
MITF O75030 1/20 0.55
HTT P42858 1/20 0.55
CYP3A4 P08684 1/20 0.51
MAOA P21397 1/20 0.51

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 0.91 MEN1 (0.85) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL8472995 0.87 KMT2A (0.54) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL15095092 0.86 MEN1 (0.77) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL9339214 0.85 MEN1 (0.55) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL9339219 0.85 MEN1 (0.55) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL14135293 0.84 MEN1 (0.52) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL435677 0.84 KMT2A (0.74) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL935186 0.84 MEN1 (1.00) MEN1KMT2AMAPTLMNANPSR1
Benzene SCHEMBL27988126 0.84 MEN1 (1.00) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL27418955 0.83 MAPT (0.50) 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-6517742-B1 2-(butyl 4'-ylaminobenzoate)-4,6-bis((1,3,3,3-tetramethyl-1 -((trimethylsilyl)oxy)disiloxanyl)propyl-3-ylamino)-s-triazine; s-triazine derivatives substituted by at least one silicone group; from cyanuric chloride L'OREAL (FR) 2003-02-11 US disclosed
US-5928630-A PROTECT AGAINST SOLAR RADIATION; ABSORB BOTH ULTRAVIOLET A AND B RADIATION Societe L' Oreal S.A. (FR) 1999-07-27 US disclosed
US-5849909-A Benzalmalonatae/phenylcyanoacrylate-substituted S-triazine compounds SOCIETE L'OREAL S.A. (FR) 1998-12-15 US disclosed