SCHEMBL9801910

SCHEMBL9801910

NNC(=O)CN1C(=O)CCCc2ccccc21

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.63
GAA P10253 2/20 0.63
ALDH1A1 P00352 1/20 0.63
THRB P10828 2/20 0.56
MAPT P10636 4/20 0.53
TP53 P04637 3/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
MAPK8 P45983 1/20 0.46
MAPK9 P45984 1/20 0.46
MAPK10 P53779 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
SCHEMBL30808574 0.92 MAPT (0.62) POLBGAAALDH1A1THRBMAPT
SCHEMBL6267953 0.82 POLB (0.58) POLBGAATHRBMEN1KMT2A
SCHEMBL31230156 0.82 POLB (0.58) POLBGAATHRBMEN1KMT2A
Hydrochloric Acid SCHEMBL5612798 0.81 POLB (0.57) POLBGAATHRBMEN1KMT2A
SCHEMBL15925412 0.81 POLB (0.60) POLBGAATHRBMAPTTP53
SCHEMBL13749552 0.78 MAPT (0.63) POLBTHRBMAPTTP53LMNA
SCHEMBL14288724 0.76 POLB (0.55) POLBGAATHRBMAPTTP53
SCHEMBL10588416 0.76 MEN1 (0.64) THRBMAPTTP53MEN1KMT2A
SCHEMBL21032963 0.75 MAPT (0.58) POLBGAAALDH1A1THRBMAPT
SCHEMBL30808581 0.75 ALDH1A1 (0.66) POLBGAAALDH1A1MAPTTP53

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
US-5055464-A Cognition activators, diuretics, antiulcer agents YOSHITOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1991-10-08 US disclosed