SCHEMBL6170167

SCHEMBL6170167

O=S(=O)(NN1CCCCC1)N1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 3/20 0.44
TSHR P16473 3/20 0.44
FKBP1A P62942 7/20 0.42
GLA P06280 1/20 0.41
USP2 O75604 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 3/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 1/20 0.34

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
SCHEMBL1646187 0.72 CA1 (0.48) CA1CA2POLBKMT2ATSHR
SCHEMBL5224904 0.72 CA1 (0.36) CA1CA2POLBKMT2ATSHR
SCHEMBL27994172 0.72 CA1 (0.55) CA1CA2POLBKMT2ATSHR
SCHEMBL5181697 0.72 CA1 (0.48) CA1CA2POLBKMT2ATSHR
SCHEMBL7024977 0.72 CA1 (0.36) CA1CA2POLBKMT2ATSHR
SCHEMBL176589 0.72 CA2 (0.36) CA1CA2POLBKMT2ATSHR
SCHEMBL17996182 0.71 FKBP1A (0.43) CA1CA2POLBKMT2ATSHR
Hydrochloric Acid SCHEMBL11534985 0.70 CA1 (0.35) CA1CA2POLBKMT2ATSHR
SCHEMBL2591313 0.70 CA12 (0.38) CA1CA2POLBKMT2ATSHR
SCHEMBL27318690 0.70 CA1 (0.35) CA1CA2POLBKMT2ATSHR

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
EP-1527051-A1 PYRIMIDYL SULPHONE AMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS Astrazeneca AB (SE) 2005-05-04 EP disclosed
WO-2004011443-A1 PYRIMIDYL SULPHONE AMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2004-02-05 WO disclosed