SCHEMBL8941594

SCHEMBL8941594

CC(C)(c1ccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1)c1ccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 1/20 0.50
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
PTPN11 Q06124 1/20 0.45
PTPN1 P18031 2/20 0.43
HSD11B1 P28845 1/20 0.42
HTT P42858 5/20 0.42
LMNA P02545 4/20 0.42
KIF11 P52732 1/20 0.41
EPAS1 Q99814 2/20 0.41
NR3C2 P08235 1/20 0.40
MAPK1 P28482 1/20 0.40
SOS1 Q07889 1/20 0.40
ALDH3A1 P30838 1/20 0.39
SCN7A Q01118 1/20 0.39
KCNH2 Q12809 1/20 0.39
SCN9A Q15858 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL8941509 0.87 NR3C2 (0.44) PTPRZ1ALDH1A1SMN1; SMN2PTPN11PTPN1
SCHEMBL11507063 0.87 PTPRZ1 (0.61) PTPRZ1ALDH1A1SMN1; SMN2PTPN1HTT
SCHEMBL8941641 0.83 PTPRZ1 (0.50) PTPRZ1ALDH1A1SMN1; SMN2PTPN1HSD11B1
SCHEMBL8941529 0.82 PTPRZ1 (0.56) PTPRZ1ALDH1A1SMN1; SMN2PTPN1HTT
SCHEMBL20007534 0.81 ALDH1A1 (0.70) ALDH1A1SMN1; SMN2HSD11B1HTTLMNA
SCHEMBL8941579 0.80 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2HTTLMNANR3C2
SCHEMBL11060588 0.79 PTPRZ1 (0.53) PTPRZ1ALDH1A1PTPN1HTTLMNA
SCHEMBL10145040 0.77 ALDH1A1 (0.69) PTPRZ1ALDH1A1SMN1; SMN2HSD11B1HTT
SCHEMBL8941541 0.77 PTPRZ1 (0.51) PTPRZ1ALDH1A1SMN1; SMN2PTPN1HTT
SCHEMBL8941500 0.77 PTPRZ1 (0.51) PTPRZ1ALDH1A1SMN1; SMN2PTPN1HTT

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-5480568-A FOR LUBRICATING METAL CONTAINING SURFACES THE DOW CHEMICAL COMPANY (US) 1996-01-02 US claimed