SCHEMBL23918458

SCHEMBL23918458

CCn1c(C)cc(=O)n1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.50
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
APP P05067 1/20 0.38
COMT P21964 2/20 0.38
CDC25A P30304 1/20 0.36
CDC25B P30305 1/20 0.36
CDC25C P30307 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 2/20 0.35
RECQL P46063 1/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
BRD4 O60885 1/20 0.35
GLO1 Q04760 1/20 0.35
IDH1 O75874 2/20 0.34

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
SCHEMBL4322190 0.90 NAPRT (0.61) NAPRTSMN1; SMN2POLBMEN1LMNA
SCHEMBL23907035 0.79 NAPRT (0.80) NAPRTFAAHMGLLAPPCOMT
SCHEMBL4341101 0.78 NAPRT (0.62) NAPRTSMN1; SMN2POLBMEN1LMNA
SCHEMBL10998478 0.76 MAPT (0.48) SMN1; SMN2POLBMAPTMEN1LMNA
SCHEMBL5421935 0.74 NAPRT (0.57) NAPRTSMN1; SMN2MAPTMEN1LMNA
SCHEMBL17035275 0.74 NAPRT (0.62) NAPRTSMN1; SMN2POLBMAPTMEN1
SCHEMBL5482874 0.74 NAPRT (0.49) NAPRTSMN1; SMN2POLBMAPTMEN1
SCHEMBL2743024 0.71 NAPRT (0.53) NAPRTSMN1; SMN2POLBMAPTLMNA
SCHEMBL10269246 0.71 NAPRT (0.53) NAPRTPOLBLMNA
SCHEMBL5426155 0.70 NAPRT (0.71) NAPRTSMN1; SMN2POLBMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3892734-A1 SCREENING METHODS AND THERAPEUTIC APPLICATIONS BASED ON BACTERIAL MOTILITY INHIBITION Ludwig-Maximilians-Universität München (DE) 2021-10-13 EP disclosed