SCHEMBL8484369

SCHEMBL8484369

[CH2]c1ccc(CN(C)S(C)(=O)=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.42
GRIA2 P42262 1/20 0.40
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
USP2 O75604 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.36
MMP3 P08254 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
ACLY P53396 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
TSHR P16473 1/20 0.35
CXCR4 P61073 2/20 0.35
NR1H3 Q13133 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
SCHEMBL12188926 0.82 HPGD (0.47) APLNRGRIA2ALDH1A1SMN1; SMN2USP2
SCHEMBL10192138 0.82 ALDH1A1 (0.49) APLNRGRIA2ALDH1A1POLBLMNA
SCHEMBL4351827 0.80 MAPT (0.43) APLNRGRIA2ALDH1A1SMN1; SMN2USP2
SCHEMBL14297420 0.80 TSHR (0.50) APLNRGRIA2ALDH1A1KDM4EMMP3
SCHEMBL7230524 0.80 CA1 (0.44) APLNRGRIA2ALDH1A1SMN1; SMN2USP2
SCHEMBL19563399 0.80 PYCR1 (0.46) APLNRGRIA2ALDH1A1SMN1; SMN2USP2
SCHEMBL2057187 0.79 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL14132725 0.77 PYCR1 (0.49) APLNRGRIA2SMN1; SMN2MEN1KMT2A
SCHEMBL12169353 0.77 KCNH2 (0.43) GRIA2ALDH1A1LMNANR1H3
SCHEMBL11609 0.77 APLNR (0.71) APLNRALDH1A1SMN1; SMN2MEN1KMT2A

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-5916891-A CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1999-06-29 US disclosed
US-5656644-A CYTOKINE SUPPRESSORS SMITHKLINE BEECHAM CORPORATION (US) 1997-08-12 US disclosed