SCHEMBL9614032

SCHEMBL9614032

CCc1cccc(CC)c1NC(=O)C(Cl)CCl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.47
CYP2C19 P33261 2/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
HIF1A Q16665 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 3/20 0.44
CACNA1C Q13936 2/20 0.44
SCN5A Q14524 2/20 0.44
NLRP3 Q96P20 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HTT P42858 3/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL6544554 0.87 ANPEP (0.47) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL6902097 0.83 ANPEP (0.52) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL9761567 0.83 NLRP3 (0.44) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL14521753 0.80 ANPEP (0.56) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL11143197 0.80 CACNA1C (0.43) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL8470544 0.80 NLRP3 (0.51) ALOX15TDP1ALDH1A1NLRP3KDM4E
SCHEMBL10959622 0.79 NLRP3 (0.58) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL9845475 0.78 ALDH1A1 (0.41) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL5087609 0.78 NR1I2 (0.43) ANPEPCYP2C19ALOX15TSHRHIF1A
SCHEMBL11154411 0.77 NLRP3 (0.49) ALOX15TDP1ALDH1A1NLRP3KDM4E

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-5155272-A Process for the production of haloacylamides MONSANTO COMPANY (US) 1992-10-13 US disclosed