SCHEMBL2592561

SCHEMBL2592561

CCOC(=O)CSc1nc2ccc(OC)c(C=O)c2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 1/20 0.51
▸ CSNK2B P67870 1/20 0.51
▸ CSNK2A1 P68400 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ KMT2A Q03164 5/20 0.44
▸ MAPT P10636 1/20 0.44
▸ POLB P06746 3/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ MEN1 O00255 3/20 0.42
▸ PRNP P04156 1/20 0.42
▸ HPGD P15428 2/20 0.42
▸ ABCB1 P08183 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TSHR P16473 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
SCHEMBL30406117 1.00 CSNK2A2 (0.51) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL22840417 0.91 CSNK2A2 (0.48) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL19604833 0.90 KMT2A (0.45) KDM4EALDH1A1KMT2AMAPTHSD17B10
SCHEMBL2571973 0.86 KMT2A (0.46) CSNK2A2CSNK2BCSNK2A1ALDH1A1KMT2A
SCHEMBL2554433 0.73 NPC1 (0.69) ALDH1A1MAPTPOLBCYP1A2CYP3A4
SCHEMBL30406237 0.73 NPC1 (0.69) ALDH1A1MAPTPOLBCYP1A2CYP3A4
SCHEMBL944312 0.70 POLB (0.72) KDM4EALDH1A1KMT2AMAPTPOLB
SCHEMBL14916139 0.69 KMT2A (0.50) CSNK2A2CSNK2BCSNK2A1KDM4EALDH1A1
SCHEMBL16181940 0.68 ALDH1A1 (0.70) KDM4EALDH1A1KMT2AMAPTPOLB
SCHEMBL25015641 0.66 ABCB1 (0.47) KDM4EALDH1A1MAPTPOLBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110172051-B IRE-1 alpha inhibitors 复星弘创(苏州)医药科技有限公司 2023-03-07 — — CN disclosed
US-11337956-B2 IRE-1α inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2022-05-24 — — US disclosed
US-11337956-B2 IRE-1α inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2022-05-24 — — US disclosed
EP-3799870-A1 IRE-1A INHIBITORS Fosun Orinove Pharmatech, Inc. (CN) 2021-04-07 — — EP disclosed
EP-3799870-A1 IRE-1A INHIBITORS Fosun Orinove Pharmatech, Inc. (CN) 2021-04-07 — — EP disclosed
EP-3409276-B1 IRE-1A INHIBITORS FOSUN ORINOVE PHARMATECH INC (CN) 2020-12-30 — — EP disclosed
EP-3409276-B1 IRE-1A INHIBITORS FOSUN ORINOVE PHARMATECH INC (CN) 2020-12-30 — — EP disclosed
US-20190314330-A1 IRE-1ALPHA INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2019-10-17 — — US disclosed
US-20190314330-A1 IRE-1ALPHA INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2019-10-17 — — US disclosed
US-10357475-B2 IRE-1α inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2019-07-23 — — US disclosed
US-9693992-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2017-07-04 — — US disclosed
US-9693992-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2017-07-04 — — US disclosed
US-9040714-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2015-05-26 — — US disclosed
US-9040714-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2015-05-26 — — US disclosed
US-20150141424-A1 IRE-1alpha INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2015-05-21 — — US disclosed
US-20150141424-A1 IRE-1alpha INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2015-05-21 — — US disclosed
US-20130116247-A1 IRE-1alpha INHIBITORS MANNKIND CORPORATION (US) 2013-05-09 — — US disclosed
US-20130116247-A1 IRE-1alpha INHIBITORS MANNKIND CORPORATION (US) 2013-05-09 — — US disclosed
EP-2555768-A2 IRE-1 INHIBITORS MannKind Corporation (US) 2013-02-13 — — EP disclosed
WO-2011127070-A2 IRE-1α INHIBITORS MANNKIND CORPORATION (US) 2011-10-13 — — 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 (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-20150141424-A1 IRE-1alpha INHIBITORS ERN1, XBP1, ERN2 CSNK2A2 3450/4885CSNK2B 3401/4885CSNK2A1 3294/4885
US-11337956-B2 IRE-1α inhibitors XBP1, ERN1, ERN2 CSNK2A2 3574/4885CSNK2B 3507/4885CSNK2A1 3432/4885
US-20190314330-A1 IRE-1ALPHA INHIBITORS ERN1, XBP1, ERN2 CSNK2A2 3450/4885CSNK2B 3401/4885CSNK2A1 3294/4885
US-10357475-B2 IRE-1α inhibitors XBP1, ERN1, ERN2 CSNK2A2 3574/4885CSNK2B 3507/4885CSNK2A1 3432/4885
US-20130116247-A1 IRE-1alpha INHIBITORS ERN1, XBP1, ERN2 CSNK2A2 3551/4885CSNK2B 3540/4885CSNK2A1 3404/4885

“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.

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