SCHEMBL7994787

SCHEMBL7994787

O=C(Cl)c1ccc(Oc2ccc(S(=O)(=O)Cl)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.44
HTT P42858 6/20 0.44
HPGD P15428 3/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.44
PARP10 Q53GL7 2/20 0.44
PARP15 Q460N3 1/20 0.44
PARP14 Q460N5 1/20 0.44
PARP16 Q8N5Y8 1/20 0.44
PARP11 Q9NR21 1/20 0.44
PARP4 Q9UKK3 1/20 0.44
SMN1; SMN2 Q16637 8/20 0.43
POLB P06746 2/20 0.43
APEX1 P27695 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 4/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL9242846 1.00 ALDH1A1 (0.44) ALDH1A1HTTHPGDKMT2AMAPT
SCHEMBL35155 0.88 ALDH1A1 (0.48) ALDH1A1HTTKMT2APOLBLMNA
SCHEMBL9769557 0.87 POLB (0.55) ALDH1A1HTTHPGDKMT2AMAPT
SCHEMBL272345 0.84 PARP10 (0.58) ALDH1A1HTTHPGDKMT2AMAPT
SCHEMBL9786679 0.84 PARP10 (0.58) ALDH1A1HTTHPGDKMT2AMAPT
SCHEMBL433497 0.84 HTT (0.58) ALDH1A1HTTKMT2AMAPTRAB9A
SCHEMBL9720036 0.84 HTT (0.58) ALDH1A1HTTKMT2AMAPTRAB9A
SCHEMBL11408710 0.82 CA12 (0.46) ALDH1A1KMT2AHSD17B10
SCHEMBL9537305 0.81 SRD5A2 (0.64) ALDH1A1HTTPARP10SMN1; SMN2POLB
SCHEMBL9249310 0.76 PARP10 (0.64) ALDH1A1HPGDKMT2AMAPTRAB9A

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-2001010838-A1 MULTIVALENT COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2001-02-15 WO disclosed