SCHEMBL4293133

SCHEMBL4293133

O=C(O)[C@@H]1CN(Cc2ccccc2)C(=O)N1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 8/20 0.58
MMP1 P03956 5/20 0.51
MMP2 P08253 4/20 0.50
MMP3 P08254 2/20 0.50
MMP9 P14780 2/20 0.50
POLB P06746 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
S1PR1 P21453 1/20 0.45
S1PR5 Q9H228 1/20 0.45
ACE P12821 1/20 0.45
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
CTSD P07339 2/20 0.44
BACE1 P56817 2/20 0.44
BRD4 O60885 1/20 0.43

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
SCHEMBL4293140 1.00 MMP13 (0.58) MMP13MMP1MMP2MMP3MMP9
SCHEMBL11197364 0.81 MMP13 (0.53) MMP13MMP1MMP2MMP3MMP9
SCHEMBL7672124 0.80 MMP13 (0.77) MMP13MMP1MMP2MMP3MMP9
SCHEMBL6691597 0.80 MMP13 (0.77) MMP13MMP1MMP2MMP3MMP9
SCHEMBL13986105 0.75 HPGD (0.46) MMP13POLBCYP2D6CYP2C9CYP2C19
SCHEMBL6698104 0.75 MMP13 (1.00) MMP13MMP1MMP2MMP3MMP9
SCHEMBL11193620 0.74 MMP13 (0.38) MMP13MMP1MMP2MMP3MMP9
SCHEMBL10341454 0.73 KMT2A (0.49) POLBCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL31581689 0.73 S1PR5 (0.59) POLBCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL20701414 0.72 NPC1 (0.51) MMP13CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62022797-A None JP disclosed
WO-2009038412-A2 BETA-SECRETASE INHIBITING COMPOUNDS LG LIFE SCIENCES, LTD. (KR) 2009-03-26 WO disclosed
JP-S6222797-A NOVEL PEPTIDE AND PRODUCTION THEREOF TANABE SEIYAKU CO LTD 1987-01-30 JP disclosed
US-4508727-A Antihypertensive 2-oxo-imidazolidine derivatives TANABE SEIYAKU CO., LTD. (JP) 1985-04-02 US disclosed
EP-0095163-A2 2-Oxo-imidazolidine compounds, a process for preparing the same and a pharmaceutical composition Tanabe Seiyaku Co., Ltd. (JP) 1983-11-30 EP disclosed
US-4380644-A HYPOTENSIVE AGENTS TANABE SIYAKU CO., LTD. (JP) 1983-04-19 US disclosed
EP-0052696-A1 Novel 2-oxoimidazolidine derivative, a process for preparing same and a pharmaceutical composition containing the 2-oxoimidazolidine derivative Tanabe Seiyaku Co., Ltd. (JP) 1982-06-02 EP disclosed