SCHEMBL28148803

SCHEMBL28148803

N#Cc1ccccc1S(=O)(=O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.50
▸ ABCC9 O60706 3/20 0.47
▸ ABCC8 Q09428 3/20 0.47
▸ KCNJ11 Q14654 3/20 0.47
▸ KCNJ8 Q15842 3/20 0.47
▸ KAT6A Q92794 4/20 0.44
▸ PTGES2 Q9H7Z7 2/20 0.44
▸ SLC22A12 Q96S37 3/20 0.43
▸ NAMPT P43490 1/20 0.41
▸ SLC40A1 Q9NP59 1/20 0.40
▸ HTR6 P50406 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ SCN9A Q15858 1/20 0.38

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
SCHEMBL163742 0.78 NAMPT (0.49) ABCC9ABCC8KCNJ11KCNJ8KAT6A
SCHEMBL22954096 0.78 KAT6A (0.53) ABCC9ABCC8KCNJ11KCNJ8KAT6A
SCHEMBL1146161 0.75 HSD11B1 (0.59) HSD11B1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL9778961 0.74 PTGES2 (0.52) ABCC9ABCC8KCNJ11KCNJ8KAT6A
SCHEMBL4072013 0.72 KAT6A (0.45) KAT6APTGES2SLC22A12NAMPTSLC40A1
SCHEMBL28811119 0.72 SLC40A1 (0.66) NAMPTSLC40A1HTT
SCHEMBL3163460 0.71 HSD11B1 (0.47) HSD11B1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL30468568 0.71 ALDH1A1 (0.62) HSD11B1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL8514629 0.71 ALDH1A1 (0.62) HSD11B1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6958215 0.71 POLB (0.50) POLB

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
CN-103384668-B compounds and compositions for inhibition of NAMPT 福马TM有限责任公司 2017-05-31 — — CN disclosed
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