SCHEMBL9728489

SCHEMBL9728489

NC(=O)c1ccccc1CNC(=S)NC(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.62
MITF O75030 1/20 0.62
ALOX12 P18054 6/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
LMNA P02545 2/20 0.56
KDM4E B2RXH2 1/20 0.56
RECQL P46063 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
POLB P06746 1/20 0.52
MAPKAPK2 P49137 1/20 0.49
NPC1 O15118 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPT P10636 2/20 0.48

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
SCHEMBL9728502 0.90 KMT2A (0.64) ALDH1A1MITFALOX12MEN1KMT2A
SCHEMBL9818475 0.86 LMNA (0.56) ALDH1A1MITFALOX12MEN1KMT2A
SCHEMBL9728776 0.86 ALDH1A1 (0.67) ALDH1A1ALOX12MEN1KMT2ALMNA
SCHEMBL9728486 0.84 ALDH1A1 (0.57) ALDH1A1ALOX12KMT2ALMNAKDM4E
SCHEMBL5458000 0.80 MEN1 (0.74) ALDH1A1MITFALOX12MEN1KMT2A
SCHEMBL14096444 0.77 ALDH1A1 (1.00) ALDH1A1MITFALOX12MEN1KMT2A
Ammonia Solution, Strong SCHEMBL29260484 0.76 ALDH1A1 (0.68) ALDH1A1MITFALOX12MEN1KMT2A
SCHEMBL2348030 0.76 ALDH1A1 (0.68) ALDH1A1MITFALOX12MEN1KMT2A
SCHEMBL12460088 0.75 NAMPT (0.50) ALDH1A1KMT2AKDM4ESMN1; SMN2MAPT
SCHEMBL9728074 0.75 ALDH1A1 (0.70) ALDH1A1ALOX12MEN1KMT2ALMNA

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
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