SCHEMBL2264974

SCHEMBL2264974

O=C1c2cc(S(=O)(=O)Cl)ccc2-c2ccc(S(=O)(=O)Cl)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.48
ALDH1A1 P00352 4/20 0.47
GAA P10253 3/20 0.47
APEX1 P27695 1/20 0.46
S100A4 P26447 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
TDP2 O95551 1/20 0.43
NSD2 O96028 1/20 0.43
HK1 P19367 1/20 0.43
PAX8 Q06710 1/20 0.43
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PARG Q86W56 2/20 0.42

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
SCHEMBL55616 0.95 PKM (0.47) PKMALDH1A1GAAAPEX1MEN1
SCHEMBL31121547 0.95 PKM (0.47) PKMALDH1A1GAAAPEX1MEN1
SCHEMBL2265043 0.95 PKM (0.47) PKMALDH1A1GAAAPEX1MEN1
SCHEMBL21104695 0.92 SMN1; SMN2 (0.54) PKMALDH1A1S100A4MEN1KMT2A
SCHEMBL30007977 0.89 KMT2A (0.56) PKMALDH1A1S100A4MEN1KMT2A
SCHEMBL919135 0.89 KMT2A (0.56) PKMALDH1A1S100A4MEN1KMT2A
SCHEMBL10070529 0.86 PARG (0.44) PKMALDH1A1MEN1KMT2APOLB
SCHEMBL25171455 0.85 TDP2 (0.56) PKMALDH1A1GAAAPEX1S100A4
Dioxane SCHEMBL28440846 0.80 PARG (0.49) PKMALDH1A1S100A4MEN1KMT2A
SCHEMBL19682469 0.79 PPOX (0.53) ALDH1A1HSD17B10TDP1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10731040-B2 Crosslinked phenolic compound, method of forming, and polymer composition containing the same THE UNIVERSITY OF MASSACHUSETTS (US) 2020-08-04 US claimed
US-20180016445-A1 CROSSLINKED PHENOLIC COMPOUND, METHOD OF FORMING, AND POLYMER COMPOSITION CONTAINING THE SAME THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2018-01-18 US claimed
US-11932599-B2 Ferroptosis inducing compound, compositions comprising the same, and methods of inducing ferroptosis UNIVERSITY OF MASSACHUSETTS (US) 2024-03-19 US disclosed
US-20220324798-A1 FERROPTOSIS INDUCING COMPOUND, COMPOSITIONS COMPRISING THE SAME, AND METHODS OF INDUCING FERROPTOSIS UNIVERSITY OF MASSACHUSETTS 2022-10-13 US disclosed
US-10947188-B2 Small molecule ferroptosis inducers THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-03-16 US disclosed
US-10947188-B2 Small molecule ferroptosis inducers THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-03-16 US disclosed
US-10731040-B2 Crosslinked phenolic compound, method of forming, and polymer composition containing the same THE UNIVERSITY OF MASSACHUSETTS (US) 2020-08-04 US disclosed
US-20190315681-A1 SMALL MOLECULE FERROPTOSIS INDUCERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2019-10-17 US disclosed
US-20190315681-A1 SMALL MOLECULE FERROPTOSIS INDUCERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2019-10-17 US disclosed
WO-2018118711-A1 SMALL MOLECULE FERROPTOSIS INDUCERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-06-28 WO disclosed
US-20180016445-A1 CROSSLINKED PHENOLIC COMPOUND, METHOD OF FORMING, AND POLYMER COMPOSITION CONTAINING THE SAME THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2018-01-18 US disclosed
US-7211695-B2 β2-adrenergic receptor agonists THERAVANCE, INC. (US) 2007-05-01 US disclosed
US-7179794-B2 Multivalent macrolide antibiotics THERAVANCE, INC. (US) 2007-02-20 US disclosed
US-7179794-B2 Multivalent macrolide antibiotics THERAVANCE, INC. (US) 2007-02-20 US disclosed
US-7173039-B2 Protein kinase inhibitors THERAVANCE, INC. (US) 2007-02-06 US disclosed
US-7173039-B2 Protein kinase inhibitors THERAVANCE, INC. (US) 2007-02-06 US disclosed
US-6693136-B1 DISULFONAMIDE DERIVATIVES; PAIN, URINARY INCONTINENCE, BLADDER OVERACTIVITY ABBOTT LABORATORIES 2004-02-17 US disclosed
US-20040019042-A1 FLUORENES AND ANTHRACENES THAT INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS ABBVIE INC. 2004-01-29 US disclosed
US-4997737-A Contain sulfonyl group EASTMAN KODAK COMPANY (US) 1991-03-05 US disclosed
US-4948911-A ELECTRON-TRANSPORT AGENTS EASTMAN KODAK COMPANY (US) 1990-08-14 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 (5 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-11932599-B2 Ferroptosis inducing compound, compositions comprising the same, and methods of inducing ferroptosis AIFM2, AIFM1, FECH PKM 2106/4885ALDH1A1 2428/4885GAA 4392/4885
US-10947188-B2 Small molecule ferroptosis inducers GPX4, AIFM2, GPX1 PKM 1696/4885ALDH1A1 845/4885GAA 2121/4885
US-20040019042-A1 FLUORENES AND ANTHRACENES THAT INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS P2RX3, P2RX1, P2RX2 PKM 2501/4885ALDH1A1 323/4885GAA 3870/4885
US-20190315681-A1 SMALL MOLECULE FERROPTOSIS INDUCERS GPX4, AIFM2, GPX1 PKM 1696/4885ALDH1A1 845/4885GAA 2121/4885
US-20220324798-A1 FERROPTOSIS INDUCING COMPOUND, COMPOSITIONS COMPRISING THE SAME, AND METHODS OF INDUCING FERROPTOSIS AIFM2, AIFM1, FECH PKM 2106/4885ALDH1A1 2428/4885GAA 4392/4885

“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.