SCHEMBL7932571

SCHEMBL7932571

CC1=C(C#N)S(=O)(=O)c2ccc(Cl)cc2N1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC8 Q09428 3/20 0.40
KCNJ11 Q14654 3/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 2/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
THRB P10828 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CHEK1 O14757 1/20 0.34
DAPK3 O43293 1/20 0.34
MAP4K4 O95819 1/20 0.34
RET P07949 1/20 0.34

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
SCHEMBL4257927 0.90 ABCC8 (0.49) ABCC8KCNJ11ALDH1A1CYP1A2LMNA
SCHEMBL4264227 0.84 CA1 (0.35) CA1CA2CA12CA4CA7
SCHEMBL4257284 0.80 MAPT (0.40) ALDH1A1CA1CA2HPGDHSD17B10
SCHEMBL7932516 0.78
SCHEMBL4256305 0.75 CA12 (0.44) ABCC8KCNJ11ALDH1A1CYP1A2LMNA
SCHEMBL7922802 0.75
SCHEMBL7929286 0.72 ABCC8 (0.45) ABCC8KCNJ11ALDH1A1CYP1A2LMNA
SCHEMBL4266841 0.72 KDM4E (0.56) ABCC8KCNJ11ALDH1A1CA1CA2
SCHEMBL7922807 0.71 ABCC8 (0.43) ABCC8KCNJ11ALDH1A1CYP1A2LMNA
SCHEMBL7931865 0.70 ABCC8 (0.41) ABCC8KCNJ11ALDH1A1CYP1A2LMNA

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-6232310-B1 ANTIDIABETIC AGENTS NOVO NORDISK A/S (DK) 2001-05-15 US claimed
US-6232310-B1 ANTIDIABETIC AGENTS NOVO NORDISK A/S (DK) 2001-05-15 US disclosed