SCHEMBL4060524

SCHEMBL4060524

CCN(CC)CCN(CC)S(=O)(=O)c1cccc(C(C)=O)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.55
▸ RECQL P46063 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ TSHR P16473 3/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ POLB P06746 2/20 0.51
▸ SERPINE1 P05121 1/20 0.50
▸ HTT P42858 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ APEX1 P27695 1/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47

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
SCHEMBL7021479 0.89 SMN1; SMN2 (0.64) ALDH1A1RECQLL3MBTL1SMN1; SMN2TSHR
SCHEMBL26313592 0.83 ALDH1A1 (0.58) ALDH1A1RECQLL3MBTL1SMN1; SMN2TSHR
SCHEMBL4053916 0.82 ALDH1A1 (0.48) ALDH1A1RECQLL3MBTL1SMN1; SMN2TSHR
SCHEMBL4053914 0.82 ALDH1A1 (0.48) ALDH1A1RECQLL3MBTL1SMN1; SMN2TSHR
SCHEMBL7506870 0.77 ALDH1A1 (0.52) ALDH1A1RECQLL3MBTL1SMN1; SMN2TSHR
SCHEMBL1421294 0.77 SMN1; SMN2 (0.68) ALDH1A1L3MBTL1SMN1; SMN2TSHRLMNA
SCHEMBL2854838 0.76 SMN1; SMN2 (0.63) ALDH1A1SMN1; SMN2TSHRLMNAMEN1
SCHEMBL19049437 0.76 SMN1; SMN2 (0.63) ALDH1A1SMN1; SMN2TSHRLMNAMEN1
SCHEMBL13286885 0.75 SERPINE1 (0.64) ALDH1A1L3MBTL1SMN1; SMN2TSHRLMNA
SCHEMBL3653439 0.75 MEN1 (0.65) ALDH1A1L3MBTL1SMN1; SMN2TSHRLMNA

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-2009111260-A1 PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-11 — — WO disclosed
Send feedback