SCHEMBL11565639

SCHEMBL11565639

CCCCCN(CCC)S(=O)(=O)c1nc[nH]n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CA12 O43570 5/20 0.37
CA9 Q16790 5/20 0.37
CA2 P00918 1/20 0.37
RAB9A P51151 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
ABCC2 Q92887 1/20 0.37
SLC22A12 Q96S37 1/20 0.37
UGT1A7 Q9HAW7 1/20 0.37
SLC22A11 Q9NSA0 1/20 0.37
VCAM1 P19320 1/20 0.36
TSHR P16473 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.36
GLA P06280 1/20 0.36

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
SCHEMBL11558400 0.99 SMN1; SMN2 (0.37) SMN1; SMN2POLBNPSR1ALDH1A1CA12
SCHEMBL11564054 0.95 SMN1; SMN2 (0.42) SMN1; SMN2POLBNPSR1ALDH1A1CA12
SCHEMBL11556664 0.92 SMN1; SMN2 (0.43) SMN1; SMN2POLBNPSR1ALDH1A1CA12
SCHEMBL11564223 0.92 NPSR1 (0.42) SMN1; SMN2POLBNPSR1ALDH1A1CA12
SCHEMBL11564619 0.91 TSHR (0.41) SMN1; SMN2POLBVCAM1TSHRMEN1
SCHEMBL11559394 0.90 TSHR (0.40) SMN1; SMN2POLBTSHRSERPINE1CNR2
SCHEMBL11556631 0.87 TSHR (0.45) SMN1; SMN2POLBALDH1A1RAB9AVCAM1
SCHEMBL11564624 0.86 NPSR1 (0.37) SMN1; SMN2POLBNPSR1ALDH1A1CA12
SCHEMBL11556702 0.84 CYP1A2 (0.37) SMN1; SMN2POLBNPSR1ALDH1A1CA12
SCHEMBL11559631 0.84 POLB (0.37) SMN1; SMN2POLBSERPINE1CNR2P4HB

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
US-4148626-A Herbicidal agents THE BOOTS COMPANY LIMITED (GB) 1979-04-10 US disclosed