SCHEMBL11512465

SCHEMBL11512465

CS(=O)(=O)NCc1ccccc1.[NaH]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.65
CA12 O43570 3/20 0.65
CA7 P43166 2/20 0.65
CA14 Q9ULX7 2/20 0.65
POLB P06746 3/20 0.65
KDM4E B2RXH2 1/20 0.65
TSHR P16473 1/20 0.65
RECQL P46063 1/20 0.65
KMT2A Q03164 2/20 0.61
CA1 P00915 2/20 0.61
KEAP1 Q14145 1/20 0.59
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
ATM Q13315 1/20 0.55
CA9 Q16790 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
HTT P42858 1/20 0.53
ALDH1A1 P00352 3/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL423037 0.98 CA2 (0.68) CA2CA12CA7CA14POLB
Hydrochloric Acid SCHEMBL3516886 0.96 CA2 (0.65) CA2CA12CA7CA14POLB
Hydrochloric Acid SCHEMBL4574707 0.96 CA2 (0.65) CA2CA12CA7CA14POLB
SCHEMBL27409054 0.92 POLB (0.61) CA2CA12CA7CA14POLB
SCHEMBL3322671 0.90 POLB (0.64) CA2CA12CA7CA14POLB
SCHEMBL15899968 0.82 CA2 (0.53) CA2CA12CA7CA14POLB
SCHEMBL6422921 0.80 KMT2A (0.63) CA2CA12CA7CA14POLB
SCHEMBL16477917 0.80 CA12 (0.68) CA2CA12CA7CA14POLB
Benzyl(Benzylsulfamoyl)Amine SCHEMBL2298224 0.79 CA12 (1.00) CA2CA12CA7CA14KMT2A
SCHEMBL24515097 0.79 CA12 (0.60) CA2CA12CA7CA14POLB

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-4161524-A INSECTICIDES, MITICIDES, NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-07-17 US disclosed
US-4134979-A INSECTICIDES, MITICIDES, NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-01-16 US disclosed