SCHEMBL9155687

SCHEMBL9155687

O=C(O)C(Nc1ccccc1)C(=O)Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
MAPT P10636 7/20 0.55
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
RXFP1 Q9HBX9 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
GAA P10253 3/20 0.50
ATM Q13315 2/20 0.50
LMNA P02545 2/20 0.50
TP53 P04637 1/20 0.50
EPHX1 P07099 1/20 0.50
TSHR P16473 1/20 0.50
EPHX2 P34913 1/20 0.50
CDK9 P50750 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
HSP90AA1 P07900 2/20 0.49
NPC1 O15118 1/20 0.49

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
SCHEMBL9155698 1.00 POLB (0.55) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL5511994 0.85 CA12 (0.50) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL27791663 0.78 HSD17B10 (0.48) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL9869885 0.78 HSD17B10 (0.48) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL7555674 0.77 POLB (0.61) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL10666925 0.76 ATM (0.49) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11404130 0.76 ATM (0.49) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11050303 0.75 POLB (0.59) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL11882145 0.74 POLB (0.63) POLBMAPTMEN1KMT2AALDH1A1
SCHEMBL14715852 0.73 POLB (0.57) POLBMAPTMEN1KMT2AALDH1A1

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-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed