SCHEMBL6065962

SCHEMBL6065962

Cn1ncc(OC(N)=O)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.36
KMT2A Q03164 2/20 0.33
VNN1 O95497 1/20 0.33
MAPT P10636 1/20 0.33
NTRK1 P04629 1/20 0.33
KCNN4 O15554 1/20 0.33
HTT P42858 1/20 0.32
GAA P10253 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM3 P20309 1/20 0.31
BCDIN3D Q7Z5W3 1/20 0.31
RIPK2 O43353 1/20 0.31

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
SCHEMBL27620811 0.84 NPC1 (0.45) LPAR1KMT2AMAPTHTTGAA
SCHEMBL6065728 0.83 SMN1; SMN2 (0.33) GAA
SCHEMBL4204205 0.80 ALDH1A1 (0.41) LPAR1KMT2AVNN1MAPTRIPK2
SCHEMBL6065837 0.79 LPAR1 (0.37) LPAR1KMT2AVNN1MAPTNTRK1
SCHEMBL3113554 0.78 KCNN4 (0.37) LPAR1VNN1KCNN4HTTCYP1A2
SCHEMBL17853170 0.77 KDM4C (0.42) LPAR1VNN1MAPTKCNN4GAA
SCHEMBL3119092 0.75 LPAR1 (0.38) LPAR1KMT2AVNN1NTRK1HTT
Carbamic Acid SCHEMBL3119184 0.74 BRD4 (0.32) LPAR1KMT2AVNN1MAPTNTRK1
SCHEMBL3105963 0.74 ALDH1A1 (0.41) LPAR1KMT2AMAPTHTTGAA
Carbamic Acid SCHEMBL3119239 0.74 BRD4 (0.32) LPAR1KMT2AVNN1MAPTNTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1663245-A1 CEPHEM COMPOUNDS Astellas Pharma Inc. (JP) 2006-06-07 EP disclosed
EP-1556389-A1 CEPHEM COMPOUNDS Astellas Pharma Inc. (JP) 2005-07-27 EP disclosed
WO-2005027909-A1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC. (JP) 2005-03-31 WO disclosed
WO-2004039814-A1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC. (JP) 2004-05-13 WO disclosed