SCHEMBL22209199

SCHEMBL22209199

O=C(O)c1cnn(-c2ccccc2F)c1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALKBH2 Q6NS38 2/20 0.63
HPGDS O60760 1/20 0.63
EGLN1 Q9GZT9 9/20 0.55
ALKBH1 Q13686 8/20 0.54
MAPK14 Q16539 1/20 0.46

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
SCHEMBL27835961 0.86 ALKBH2 (0.45) ALKBH2HPGDSEGLN1ALKBH1MAPK14
SCHEMBL14947694 0.86 ALKBH2 (0.45) ALKBH2HPGDSEGLN1ALKBH1MAPK14
SCHEMBL20263286 0.83 ALKBH2 (0.43) ALKBH2HPGDSEGLN1ALKBH1MAPK14
SCHEMBL26054428 0.82 ALKBH2 (0.42) ALKBH2HPGDSEGLN1ALKBH1MAPK14
SCHEMBL4647029 0.81 ALKBH1 (0.56) ALKBH2HPGDSEGLN1ALKBH1
SCHEMBL30529091 0.81 ALKBH1 (0.56) ALKBH2HPGDSEGLN1ALKBH1
SCHEMBL2861126 0.81 ALKBH2 (0.63) ALKBH2HPGDSEGLN1ALKBH1
SCHEMBL11480162 0.81 ALKBH2 (0.63) ALKBH2HPGDSEGLN1ALKBH1MAPK14
SCHEMBL22396399 0.80 ALKBH2 (0.58) ALKBH2HPGDSEGLN1ALKBH1
SCHEMBL14692557 0.79 EGLN1 (0.53) ALKBH2HPGDSEGLN1ALKBH1

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
WO-2020146779-A1 mTORC1 INHIBITORS FOR ACTIVATING AUTOPHAGY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-07-16 WO disclosed
WO-2020146779-A1 mTORC1 INHIBITORS FOR ACTIVATING AUTOPHAGY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-07-16 WO disclosed