SCHEMBL7941480

SCHEMBL7941480

CC1(C)C[C@]1(C=C(Cl)Cl)C(=O)OCc1cccc(Oc2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.58
LMNA P02545 1/20 0.58
ADRA2A P08913 1/20 0.58
CNR1 P21554 1/20 0.58
ATM Q13315 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MMP1 P03956 2/20 0.45
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
FFAR4 Q5NUL3 7/20 0.44
FFAR1 O14842 5/20 0.42
CETP P11597 1/20 0.42
FKBP1A P62942 2/20 0.41
HTR1A P08908 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
HTR2C P28335 1/20 0.40
OPRK1 P41145 1/20 0.40
SLC6A3 Q01959 1/20 0.40

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
SCHEMBL5368035 0.88 TDP1 (0.52) TDP1LMNAADRA2ACNR1ATM
SCHEMBL5368041 0.88 TDP1 (0.52) TDP1LMNAADRA2ACNR1ATM
SCHEMBL11467686 0.88 TDP1 (0.50) TDP1LMNAADRA2ACNR1ATM
SCHEMBL5370676 0.87 TDP1 (0.51) TDP1LMNAADRA2ACNR1ATM
SCHEMBL5370238 0.87 TDP1 (0.51) TDP1LMNAADRA2ACNR1ATM
SCHEMBL5370243 0.87 TDP1 (0.51) TDP1LMNAADRA2ACNR1ATM
SCHEMBL5370679 0.87 TDP1 (0.51) TDP1LMNAADRA2ACNR1ATM
SCHEMBL10908930 0.78 TDP1 (0.64) TDP1LMNAADRA2ACNR1ATM
SCHEMBL11623713 0.78 TDP1 (0.64) TDP1LMNAADRA2ACNR1ATM
SCHEMBL10908934 0.76 TDP1 (0.61) TDP1LMNAADRA2ACNR1ATM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001000720-A1 POLYURETHANE FOAM ANTIMICROBIAL FINISH USING ZINC-BIS-(2-PYRIDINTHIOL-1-OXIDE) AND OTHER ACTIVE INGREDIENTS SANITIZED AG (CH) 2001-01-04 WO claimed
WO-2001000720-A1 POLYURETHANE FOAM ANTIMICROBIAL FINISH USING ZINC-BIS-(2-PYRIDINTHIOL-1-OXIDE) AND OTHER ACTIVE INGREDIENTS SANITIZED AG (CH) 2001-01-04 WO disclosed
WO-2001000720-A1 POLYURETHANE FOAM ANTIMICROBIAL FINISH USING ZINC-BIS-(2-PYRIDINTHIOL-1-OXIDE) AND OTHER ACTIVE INGREDIENTS SANITIZED AG (CH) 2001-01-04 WO disclosed