SCHEMBL16992199

SCHEMBL16992199

Cc1ccc(S(=O)(=O)N/N=C/[C@H]2CCCN2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 5/20 0.46
PRSS1 P07477 5/20 0.46
PRSS2 P07478 5/20 0.46
PRSS3 P35030 5/20 0.46
POLB P06746 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 1/20 0.41
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
NFKB1 P19838 1/20 0.41
LMNA P02545 1/20 0.40
AKR1C3 P42330 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
SCHEMBL16992202 1.00 F2 (0.46) F2PRSS1PRSS2PRSS3POLB
SCHEMBL18314687 0.85 LMNA (0.47) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL5330597 0.85 LMNA (0.47) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL5330600 0.85 LMNA (0.47) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL5328711 0.82 MMP13 (0.45) F2PRSS1PRSS2PRSS3POLB
SCHEMBL5375740 0.82 MMP13 (0.45) F2PRSS1PRSS2PRSS3POLB
SCHEMBL5328714 0.82 MMP13 (0.45) F2PRSS1PRSS2PRSS3POLB
SCHEMBL20135393 0.79 ALDH1A1 (0.44) F2PRSS1PRSS2PRSS3POLB
SCHEMBL26676486 0.75 ALDH1A1 (0.46) F2PRSS1PRSS2PRSS3POLB
SCHEMBL20476798 0.74 ALDH1A1 (0.49) F2PRSS1PRSS2PRSS3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11786524-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (GB) 2023-10-17 US disclosed
US-20210275525-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2021-09-09 US disclosed
EP-3811944-A1 PHARMACEUTICAL COMPOUNDS AS CHK1 INHIBITORS Sentinel Oncology Limited (GB) 2021-04-28 EP disclosed
US-10973817-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (GB) 2021-04-13 US disclosed
EP-3104860-B1 PHARMACEUTICAL COMPOUNDS AS CHK1 INHIBITORS SENTINEL ONCOLOGY LTD (GB) 2020-12-30 EP disclosed
US-20180271860-A1 PHARMACEUTICAL COMPOUNDS CASCADIAN THERAPEUTICS, INC. (US) 2018-09-27 US disclosed
US-10010547-B2 Pharmaceutical compounds CASCADIAN THERAPEUTICS, INC. (US) 2018-07-03 US disclosed
EP-3104860-A1 PHARMACEUTICAL COMPOUNDS Cascadian Therapeutics, Inc. (US) 2016-12-21 EP disclosed
US-20160361310-A1 PHARMACEUTICAL COMPOUNDS SEATTLE GENETICS, INC. 2016-12-15 US disclosed
WO-2015120390-A1 PHARMACEUTICAL COMPOUNDS ONCOTHYREON INC. (US) 2015-08-13 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 (6 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-10010547-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 F2 4568/4885PRSS1 1447/4885PRSS2 2617/4885
US-20180271860-A1 PHARMACEUTICAL COMPOUNDS CHKA, CHKB, TNK2 F2 4568/4885PRSS1 1447/4885PRSS2 2617/4885
US-11786524-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 F2 4568/4885PRSS1 1447/4885PRSS2 2617/4885
US-20160361310-A1 PHARMACEUTICAL COMPOUNDS CHKA, CHKB, TNK2 F2 4568/4885PRSS1 1447/4885PRSS2 2617/4885
US-20210275525-A1 PHARMACEUTICAL COMPOUNDS CHKA, CHKB, TNK2 F2 4568/4885PRSS1 1447/4885PRSS2 2617/4885
US-10973817-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 F2 4568/4885PRSS1 1447/4885PRSS2 2617/4885

“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.