SCHEMBL22869375

SCHEMBL22869375

CC(C)NS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA9 Q16790 1/20 0.60
ALDH1A1 P00352 4/20 0.54
LMNA P02545 4/20 0.54
POLB P06746 2/20 0.54
KDM4E B2RXH2 1/20 0.53
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
NAMPT P43490 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.51
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
CRHBP P24387 1/20 0.48
HTT P42858 1/20 0.48
CRHR2 Q13324 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL10067645 0.83 CA12 (0.66) CA12CA1CA2CA9ALDH1A1
SCHEMBL18851155 0.81 CA12 (0.64) CA12CA1CA2CA9ALDH1A1
SCHEMBL7908701 0.81 POLB (0.68) CA12CA1CA2CA9ALDH1A1
SCHEMBL18850964 0.79 CA12 (0.70) CA12CA1CA2CA9ALDH1A1
SCHEMBL31195191 0.78 ALDH1A1 (0.57) CA12CA1CA2CA9ALDH1A1
SCHEMBL10680164 0.77 ALDH1A1 (0.56) CA12CA1CA2CA9ALDH1A1
SCHEMBL19777840 0.76 CA12 (0.66) CA12CA1CA2CA9ALDH1A1
SCHEMBL9568652 0.76 TGM2 (0.65) ALDH1A1LMNAPOLBKMT2AMEN1
SCHEMBL396730 0.76 RXFP1 (0.62) CA1CA2ALDH1A1LMNAPOLB
SCHEMBL16057183 0.76 CA1 (1.00) CA12CA1CA2CA9KMT2A

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
WO-2021003399-A1 ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES AND RELATED METHODS ICONIC THERAPEUTICS, INC. (US) 2021-01-07 WO disclosed