SCHEMBL2448610

SCHEMBL2448610

CC(C)CCS(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.56
ALDH1A1 P00352 3/20 0.50
TP53 P04637 2/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HSD11B1 P28845 4/20 0.47
MMP1 P03956 1/20 0.46
MMP13 P45452 1/20 0.46
MMP2 P08253 1/20 0.45
MMP3 P08254 1/20 0.45
MMP9 P14780 1/20 0.45
MMP14 P50281 1/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
KMT2A Q03164 3/20 0.43
NPC1 O15118 1/20 0.43
S1PR2 O95136 1/20 0.43
LMNA P02545 1/20 0.43
PRNP P04156 1/20 0.43
XBP1 P17861 1/20 0.43

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
SCHEMBL2448975 0.88 PSIP1 (0.52) PSIP1ALDH1A1HTTHSD11B1MMP1
SCHEMBL16485594 0.86 PSIP1 (0.46) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL28763540 0.84 PSIP1 (0.52) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL20996662 0.84 MMP13 (0.65) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL28973817 0.84 PSIP1 (0.52) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL28973785 0.84 PSIP1 (0.52) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL2443006 0.82 PSIP1 (0.55) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL6825821 0.82 ALDH1A1 (0.64) ALDH1A1MMP1MMP13MAPTSMN1; SMN2
SCHEMBL7000851 0.81 PSIP1 (0.48) PSIP1ALDH1A1TP53HTTHSD17B10
SCHEMBL26361877 0.81 PSIP1 (0.53) PSIP1ALDH1A1TP53HTTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease STANFORD RES INST INT (US) 2024-07-11 US disclosed
US-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease STANFORD RES INST INT (US) 2024-07-11 US disclosed
US-20210290591-A1 IMMUNOMODULATING UREA AZALIDES ZOETIS SERVICES LLC 2021-09-23 US disclosed
US-10865213-B2 Max binders as MYC modulators and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-12-15 US disclosed
EP-2776040-B1 4-PREGENEN-11SS-17-21-TRIOL-3,20-DIONE DERIVATIVES FOR THE TREATMENT OF OCULAR CONDITIONS ALLERGAN INC (US) 2020-04-22 EP disclosed
US-20190144466-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2019-05-16 US disclosed
US-20180036233-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY ALLERGAN, INC. 2018-02-08 US disclosed
US-20180036233-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY ALLERGAN, INC. 2018-02-08 US disclosed
WO-2017143059-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-08-24 WO disclosed
US-20170233405-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2017-08-17 US disclosed
US-20040122218-A1 Pyrrolopyridine potassium channel openers ABBOTT LABORATORIES 2004-06-24 US disclosed
US-6645968-B2 E.g., N-(1-((anilinocarbonyl)amino)-2,2,2-trichloroethyl)-4-methyl-benzamide; antiepileptic, -ischemic and cardiotonic agents; sexual, eating and urogenital disorders; asthma; migraines; ABBOTT LABORATORIES 2003-11-11 US disclosed
WO-2003089404-A1 NAPHTHALENE AMIDES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2003-10-30 WO disclosed
US-20030199578-A1 Naphthalene amides as potassium channel openers ABBOTT LABORATORIES 2003-10-23 US disclosed
US-6495576-B2 N-(1-((3,4-DIOXO-2-(3-PYRIDINYLAMINO)-1-CYCLOBUTEN-1-YL)AMINO) -2,2-DIMETHYLPROPYL)-4-METHYLBENZAMIDE FOR EXAMPLE; TREATING BLADDER OVERACTIVITY, BENIGN PROSTATIC HYPERPLASIA, PREMATURE LABOR, AND SEXUAL DISORDERS ABBOTT LABORATORIES 2002-12-17 US disclosed
US-20020165264-A1 Aminal diones as potassium channel openers ABBOTT LABORATORIES 2002-11-07 US disclosed
US-20020147230-A1 Aminal Diones as potassium channel openers ABBOTT LABORATORIES 2002-10-10 US disclosed
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 US disclosed
US-4719204-A ANIMAL FEED WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1988-01-12 US disclosed
WO-1985003939-A1 1alpha-HYDROXYVITAMIN D2 ANALOGS AND PROCESS FOR PREPARING SAME WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1985-09-12 WO 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 (11 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-20180036233-A1 SELF-EMULSIFYING DRUG DELIVERY (SEDDS) FOR OPHTHALMIC DRUG DELIVERY LSS, SBDS, SPAST PSIP1 2462/4885ALDH1A1 1834/4885TP53 1785/4885
US-20020028836-A1 Potassium channel openers KCNJ2, KCNJ11, KCNJ1 PSIP1 2916/4885ALDH1A1 704/4885TP53 4315/4885
US-20040122218-A1 Pyrrolopyridine potassium channel openers KCNJ2, KCNN1, KCNN2 PSIP1 2256/4885ALDH1A1 1725/4885TP53 3740/4885
US-20030199578-A1 Naphthalene amides as potassium channel openers KCNJ2, KCNN2, KCNJ1 PSIP1 2667/4885ALDH1A1 1856/4885TP53 2545/4885
US-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease RNASEH1, RNASEL, DNASE1 PSIP1 2843/4885ALDH1A1 802/4885TP53 778/4885
US-20020147230-A1 Aminal Diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 PSIP1 4760/4885ALDH1A1 132/4885TP53 4774/4885
US-20170233405-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MYC, MYCBP, MYCBP2 PSIP1 1185/4885ALDH1A1 3226/4885TP53 57/4885
US-10865213-B2 Max binders as MYC modulators and uses thereof MYC, MYCBP, MYCBP2 PSIP1 1185/4885ALDH1A1 3226/4885TP53 57/4885
US-20210290591-A1 IMMUNOMODULATING UREA AZALIDES ARG1, IL2, CD209 PSIP1 3651/4885ALDH1A1 371/4885TP53 939/4885
US-20020165264-A1 Aminal diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 PSIP1 4760/4885ALDH1A1 132/4885TP53 4774/4885
US-20190144466-A1 MAX BINDERS AS MYC MODULATORS AND USES THEREOF MYC, MYCBP, MYCBP2 PSIP1 1185/4885ALDH1A1 3226/4885TP53 57/4885

“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.