SCHEMBL4154539

SCHEMBL4154539

O=C=Nc1ccc(O)c(S(=O)(=O)N=C=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.41
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 4/20 0.39
TRPA1 O75762 1/20 0.39
PTGS1 P23219 4/20 0.36
PTGS2 P35354 4/20 0.36
RAD1 O60671 1/20 0.36
P2RY6 Q15077 1/20 0.36
TSHR P16473 1/20 0.35
GLO1 Q04760 3/20 0.35
PLCG1 P19174 1/20 0.34
HSD17B10 Q99714 4/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 2/20 0.33
USP2 O75604 2/20 0.33
LTA P01374 2/20 0.33
MAPT P10636 2/20 0.33
P2RX3 P56373 2/20 0.33
RAD51 Q06609 2/20 0.33

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
SCHEMBL5657224 0.80 CYP3A4 (0.54) TDP1MAPK1CYP3A4TRPA1RAD1
SCHEMBL8853900 0.77 MAPK1 (0.58) TDP1MAPK1CYP3A4TRPA1PTGS1
SCHEMBL5657231 0.77 CYP3A4 (0.50) TDP1MAPK1CYP3A4TRPA1TSHR
SCHEMBL28571018 0.75 TDP1 (0.37) TDP1MAPK1CYP3A4TRPA1RAD1
SCHEMBL10396139 0.75 CA1 (0.39) TDP1MAPK1CYP3A4TRPA1PTGS1
SCHEMBL30932296 0.74 MAPK1 (0.52) TDP1MAPK1CYP3A4TRPA1PTGS1
SCHEMBL8348200 0.74 MAPK1 (0.52) TDP1MAPK1CYP3A4TRPA1PTGS1
SCHEMBL10885567 0.73 CDK2 (0.37) TDP1MAPK1CYP3A4HSD17B10ALDH1A1
SCHEMBL182964 0.71 CYP3A4 (0.47) TDP1MAPK1CYP3A4TRPA1PTGS1
SCHEMBL11191075 0.71 CYP3A4 (0.60) TDP1MAPK1CYP3A4TRPA1PTGS1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1609362-B1 Non-systemic control of parasites BAYER IP GMBH (DE) 2015-03-18 EP disclosed
US-8728507-B2 Non-systemic control of parasites BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-05-20 US disclosed
US-7517535-B2 Non-systemic control of parasites BAYER ANIMAL HEALTH GMBH (DE) 2009-04-14 US disclosed
US-20080108671-A1 NON-SYSTEMIC CONTROL OF PARASITES BAYER HEALTHCARE AG (DE) 2008-05-08 US disclosed
US-20080108670-A1 NON-SYSTEMIC CONTROL OF PARASITES BAYER HEALTHCARE AG (DE) 2008-05-08 US disclosed
US-20060276517-A1 Non-systemic control of parasites BAYER HEALTHCARE AG (DE) 2006-12-07 US disclosed
EP-1609362-A2 Non-systemic control of parasites Bayer HealthCare AG (DE) 2005-12-28 EP disclosed
EP-0682869-B1 Non-systemic control of parasites BAYER HEALTHCARE AG (DE) 2005-12-21 EP disclosed
US-20050222217-A1 Non-systemic control of parasites BAYER HEALTHCARE AG (DE) 2005-10-06 US disclosed
US-6896891-B2 Non-systemic control of parasites BAYER AKTIENGESELLSCHAFT (DE) 2005-05-24 US disclosed
US-6329374-B1 CONTROLLING PARASITES SUCH AS LICE AND FLEAS BAYER AKTIENGESELLSCHAFT (DE) 2001-12-11 US disclosed
US-20010044456-A1 Antagonists/agonists of nicotinergic acetylcholine receptors in insects; imidacloprid; such as fleas, lice and flies BAYER INTELLECTUAL PROPERTY GMBH (DE) 2001-11-22 US disclosed
US-20010041723-A1 Non-systemic control of parasites BAYER INTELLECTUAL PROPERTY GMBH (DE) 2001-11-15 US disclosed
US-20010027201-A1 Non-systemic control of parasites BAYER INTELLECTUAL PROPERTY GMBH (DE) 2001-10-04 US disclosed
US-20010021716-A1 Non-systemic control of parasites BAYER INTELLECTUAL PROPERTY GMBH (DE) 2001-09-13 US disclosed
US-6232328-B1 CONTACTING FLEAS AND LIC ON A HUMAN OR ANIMALS WITH AN IMIDAZOLINIUM COMPOUND TO KILL FLIES AND INSECTS BAYER AKTIENGESELLSCHAFT (DE) 2001-05-15 US disclosed
EP-0682869-A1 Non-systemic control of parasites BAYER AG (DE) 1995-11-22 EP disclosed
US-5294445-A Animal collars BAYER AKTIENGESELLSCHAFT (DE) 1994-03-15 US disclosed
EP-0569791-A2 Shaped bodies for the control of ektoparasites on animals BAYER AG (DE) 1993-11-18 EP disclosed
EP-0528303-A1 Shaped bodies for the control of undesired organisms BAYER AG (DE) 1993-02-24 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060276517-A1 Non-systemic control of parasites CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885
US-20080108671-A1 NON-SYSTEMIC CONTROL OF PARASITES CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885
US-20010021716-A1 Non-systemic control of parasites CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885
US-20050222217-A1 Non-systemic control of parasites CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885
US-20080108670-A1 NON-SYSTEMIC CONTROL OF PARASITES CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885
US-20010027201-A1 Non-systemic control of parasites CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885
US-20010044456-A1 Antagonists/agonists of nicotinergic acetylcholine receptors in insects; imidacloprid; such as fleas, lice and flies CHRNG, CHRNE, CHRNA1 TDP1 3420/4885MAPK1 1979/4885CYP3A4 1238/4885
US-20010041723-A1 Non-systemic control of parasites CHRNG, CHRNA1, CHRM3 TDP1 3485/4885MAPK1 2750/4885CYP3A4 1573/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.