SCHEMBL11044807

SCHEMBL11044807

O=C(Cn1cnc(Cl)c1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.44
ALPL P05186 4/20 0.43
PLAA Q9Y263 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TRPA1 O75762 1/20 0.43
MAPK1 P28482 1/20 0.43
GSK3B P49841 1/20 0.43
HIF1A Q16665 1/20 0.43
ALPG P10696 2/20 0.43
MEN1 O00255 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42

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
SCHEMBL4969959 0.81 ALPL (0.65) POLBL3MBTL1SMN1; SMN2ALPLPLAA
SCHEMBL11716674 0.81 ALPL (0.65) POLBL3MBTL1SMN1; SMN2ALPLPLAA
SCHEMBL9795232 0.81 POLB (0.48) POLBL3MBTL1SMN1; SMN2ALPLPLAA
SCHEMBL11309741 0.79 ALDH1A1 (0.42) POLBL3MBTL1ALPLPLAAALDH1A1
SCHEMBL10926010 0.76 KDM4C (0.39) POLBL3MBTL1SMN1; SMN2ALDH1A1MEN1
SCHEMBL12060163 0.76 HMOX1 (0.51) L3MBTL1TRPA1MEN1KMT2A
SCHEMBL28267245 0.75 PLAA (0.59) POLBSMN1; SMN2PLAAALDH1A1TRPA1
SCHEMBL9640838 0.73 MCL1 (0.37) L3MBTL1SMN1; SMN2ALPLPLAAALDH1A1
SCHEMBL19925217 0.72 HPGDS (0.53) POLBCYP19A1CYP11B1CYP11B2
SCHEMBL28115922 0.71 KDM4E (0.57) L3MBTL1SMN1; SMN2ALDH1A1TRPA1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0027177-B1 1-AZOLYL-1-HALOGEN-ALKAN-2-ONES AND PROCESS FOR THE PREPARATION OF 1-AZOLYL-1-PHENOXY-ALKAN-2-ONES BAYER AG (DE) 1984-05-02 EP disclosed
EP-0027177-A1 1-Azolyl-1-halogen-alkan-2-ones and process for the preparation of 1-azolyl-1-phenoxy-alkan-2-ones BAYER AG (DE) 1981-04-22 EP disclosed