SCHEMBL9728720

SCHEMBL9728720

CNC(=O)c1ccccc1NC(=S)NC(=O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.74
KDM4E B2RXH2 6/20 0.74
MAPT P10636 4/20 0.74
ALOX12 P18054 2/20 0.74
KMT2A Q03164 2/20 0.74
MEN1 O00255 1/20 0.74
HPGD P15428 1/20 0.74
EPHX1 P07099 2/20 0.68
POLB P06746 2/20 0.64
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
NPSR1 Q6W5P4 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
GAA P10253 1/20 0.56
CYP1A2 P05177 1/20 0.56
ALPL P05186 1/20 0.56
ALPI P09923 1/20 0.56
ALPG P10696 1/20 0.56

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
SCHEMBL9818510 0.90 ALDH1A1 (0.76) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL9728607 0.87 EPHX1 (0.71) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL6118209 0.85 EPHX1 (0.78) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL11165411 0.85 ALDH1A1 (0.71) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL9728405 0.85 ALDH1A1 (0.77) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL9728074 0.85 ALDH1A1 (0.70) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL5713527 0.81 EPHX1 (1.00) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL8612464 0.81 EPHX1 (0.77) ALDH1A1KDM4EMAPTALOX12KMT2A
SCHEMBL2680169 0.80 ALDH1A1 (0.66) ALDH1A1KDM4EALOX12KMT2AMEN1
SCHEMBL18550720 0.80 NPC1 (0.71) ALDH1A1KDM4EMAPTALOX12KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001157-A Substituted N-[[2-(aminocarbonyl)phenylamino]thioxomethyl]benzamides AMERICAN CYANAMID COMPANY (US) 1991-03-19 US claimed
US-5084457-A Cognition activators and nervous system disorders AMERICAN CYANAMID COMPANY (US) 1992-01-28 US disclosed
US-5001157-A Substituted N-[[2-(aminocarbonyl)phenylamino]thioxomethyl]benzamides AMERICAN CYANAMID COMPANY (US) 1991-03-19 US disclosed