SCHEMBL20007647

SCHEMBL20007647

Cc1ccc(S(=O)(=O)N2CC[C@](O)(CO)C2)nn1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RBP1 P09455 1/20 0.39
FPR2 P25090 7/20 0.35
PROKR1 Q8TCW9 7/20 0.35
SMN1; SMN2 Q16637 5/20 0.34
ALDH1A1 P00352 5/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 3/20 0.34
GAA P10253 4/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
SLC6A9 P48067 1/20 0.31
NAMPT P43490 1/20 0.31

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
SCHEMBL23613990 0.77 TRPV4 (0.41) RBP1SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL20007693 0.77 TRPV4 (0.41) RBP1SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL20007310 0.73 TRPV4 (0.49)
SCHEMBL20007244 0.73 TRPV4 (0.46) GAAPOLB
SCHEMBL20007811 0.73 TRPV4 (0.41) RBP1SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL23613910 0.70 HTR2A (0.46) RBP1SMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL23613838 0.70 TRPV4 (0.50) RBP1SMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL20007271 0.69 TRPV4 (0.43) RBP1
SCHEMBL20003707 0.68 TRPV4 (0.52) RBP1ALDH1A1KMT2AMEN1
SCHEMBL23614038 0.68 RBP1 (0.36) RBP1FPR2PROKR1SMN1; SMN2ALDH1A1

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-2018055524-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 WO disclosed