SCHEMBL23699006

SCHEMBL23699006

Cc1cccc(C)c1S(=O)(=O)n1ccnc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
HTT P42858 2/20 0.51
FABP4 P15090 1/20 0.51
TP53 P04637 1/20 0.50
LMNA P02545 1/20 0.49
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
NAAA Q02083 1/20 0.39
RAPGEF4 Q8WZA2 1/20 0.35

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
SCHEMBL841998 0.83 TSHR (0.58) TSHRHTTFABP4TP53LMNA
SCHEMBL4727160 0.81 HTT (0.57) TSHRHTTFABP4TP53LMNA
SCHEMBL14529331 0.80 HTT (0.52) TSHRHTTFABP4TP53LMNA
SCHEMBL4970093 0.76 HTT (0.49) TSHRHTTFABP4TP53LMNA
SCHEMBL28303262 0.76 HTT (0.49) TSHRHTTFABP4TP53LMNA
SCHEMBL217862 0.74 TP53 (0.69) TSHRHTTFABP4TP53LMNA
SCHEMBL4728733 0.73 TP53 (0.63) TSHRHTTFABP4TP53LMNA
Ammonia Solution, Strong SCHEMBL28097128 0.72 TP53 (0.67) TSHRHTTFABP4TP53LMNA
SCHEMBL10801457 0.72 SMN1; SMN2 (0.65) TSHRHTTFABP4TP53LMNA
SCHEMBL27855435 0.71 TSHR (0.46) TSHRHTTTP53MEN1KMT2A

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-3856742-A1 TRICYCLIC JANUS KINASE 1 INHIBITORS, AND COMPOSITIONS AND METHODS THEREOF Lynk Pharmaceuticals Co. Ltd. (CN) 2021-08-04 EP disclosed