SCHEMBL17044667

SCHEMBL17044667

C=Cc1ccc(S(=O)(=O)NC(=O)C(=C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.49
DHFR P00374 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
MCL1 Q07820 2/20 0.40
POLB P06746 2/20 0.38
PKM P14618 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC4 P56524 2/20 0.37
HDAC8 Q9BY41 1/20 0.37
LMNA P02545 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
MMP1 P03956 1/20 0.36

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
SCHEMBL12264953 0.85 TDP1 (0.61) TDP1DHFRTSHRSMN1; SMN2AKR1C2
SCHEMBL195196 0.81 LMNA (0.56) TDP1TSHRSMN1; SMN2NPSR1POLB
SCHEMBL193976 0.80 BCAT1 (0.53) TDP1DHFRTSHRSMN1; SMN2ALDH1A1
SCHEMBL17044647 0.78 TDP1 (0.53) TDP1DHFRTSHRSMN1; SMN2NPSR1
SCHEMBL7784535 0.77 MMP2 (0.57) PKMALDH1A1CA1CA2CA12
SCHEMBL16659791 0.74 FFAR4 (0.49) TDP1DHFRTSHRSMN1; SMN2POLB
SCHEMBL1494528 0.73 SMN1; SMN2 (0.57) TDP1SMN1; SMN2MCL1ALDH1A1LMNA
SCHEMBL8658489 0.73 FLT1 (0.65) TDP1AKR1C2AKR1C1MCL1LMNA
Methacrylic Acid SCHEMBL460576 0.73 ALDH1A1 (0.50) TDP1TSHRPOLBALDH1A1HDAC8
SCHEMBL17827609 0.73 TDP1 (0.59) TDP1TSHRSMN1; SMN2NPSR1MCL1

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
US-9505713-B2 High-purity sodium p-styrenesulfonate with excellent hue, method for producing the same, poly(sodium p-styrenesulfonate) with excellent hue using the same, and dispersant and synthetic starch for clothing finishing using the poly(sodium p-styrenesulfonate) TOSOH ORGANIC CHEMICAL CO., LTD (JP) 2016-11-29 US disclosed
US-20150246876-A1 HIGH-PURITY SODIUM P-STYRENESULFONATE WITH EXCELLENT HUE, METHOD FOR PRODUCING THE SAME, POLY (SODIUM P-STYRENESULFONATE) WITH EXCELLENT HUE USING THE SAME, AND DISPERSANT AND SYNTHETIC STARCH FOR CLOTHING FINISHING USING THE POLY ( SODIUM P-STYRENESULFONATE) TOSOH ORGANIC CHEMICAL CO., LTD. (JP) 2015-09-03 US 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 (1 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-20150246876-A1 HIGH-PURITY SODIUM P-STYRENESULFONATE WITH EXCELLENT HUE, METHOD FOR PRODUCING THE SAME, POLY (SODIUM P-STYRENESULFONATE) WITH EXCELLENT HUE USING THE SAME, AND DISPERSANT AND SYNTHETIC STARCH FOR CLOTHING FINISHING USING THE POLY ( SODIUM P-STYRENESULFONATE) HPSE, STS, TST TDP1 2501/4885DHFR 3354/4885TSHR 2827/4885

“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.