SCHEMBL7602192

SCHEMBL7602192

CCCNC(=O)c1ccc(NC(=O)NS(=O)(=O)c2cccc(Cl)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 12/20 0.60
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
CYP3A4 P08684 1/20 0.50
THRB P10828 1/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
HTR2A P28223 1/20 0.50
CYP2C19 P33261 1/20 0.50
ADRA1A P35348 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47

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
SCHEMBL6428589 0.90 FBP1 (0.59) FBP1ALDH1A1SMN1; SMN2LMNACYP3A4
SCHEMBL6329987 0.88 FBP1 (0.61) FBP1ALDH1A1NAMPT
SCHEMBL6331436 0.86 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2LMNACYP3A4THRB
SCHEMBL6323768 0.86 LMNA (0.54) ALDH1A1SMN1; SMN2LMNACYP3A4THRB
SCHEMBL6329887 0.82 FBP1 (0.57) FBP1ALDH1A1SMN1; SMN2LMNACYP3A4
SCHEMBL6721144 0.82 FBP1 (0.59) FBP1ALDH1A1SMN1; SMN2THRBKMT2A
SCHEMBL9487941 0.81 FBP1 (0.79) FBP1PGRKMT2ACA12CA1
SCHEMBL6321364 0.81 CA1 (0.61) ALDH1A1SMN1; SMN2LMNACYP3A4THRB
SCHEMBL6331865 0.80 LMNA (0.62) FBP1ALDH1A1SMN1; SMN2LMNACYP3A4
SCHEMBL6323967 0.79 LMNA (0.51) ALDH1A1SMN1; SMN2LMNACYP3A4THRB

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
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed