SCHEMBL21707954

SCHEMBL21707954

CCOC(=O)c1c(F)c(S(=O)(=O)NC(C)CC)cn1C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 4/20 0.38
TSHR P16473 1/20 0.35
GAA P10253 1/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 1/20 0.34
RECQL P46063 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL16236839 1.00 SMN1; SMN2 (0.42) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL28522731 0.92 KMT2A (0.35) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL16992971 0.90 POLB (0.37) KMT2AALDH1A1TSHRGAAPOLB
Hydrochloric Acid SCHEMBL28526027 0.90 KMT2A (0.34) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL16992936 0.86 PDK1 (0.36) SMN1; SMN2KMT2AALDH1A1TSHRGAA
SCHEMBL16237218 0.86 PDK1 (0.36) SMN1; SMN2KMT2AALDH1A1TSHRGAA
SCHEMBL18261880 0.86 PDK1 (0.36) SMN1; SMN2KMT2AALDH1A1TSHRGAA
SCHEMBL16236640 0.86 PDK1 (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL16992898 0.86 PDK1 (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL18261877 0.86 PDK1 (0.38) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR

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-3121164-B1 SULPHAMOYLPYRROLAMIDE DERIVATIVES AND THE USE THEREOF AS MEDICAMENTS FOR THE TREATMENT OF HEPATITIS B JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2020-02-19 EP disclosed