SCHEMBL20338809

SCHEMBL20338809

O=C(O)c1cccc(Nc2nccc3ccc(Cl)cc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 7/20 0.55
CSNK2A2 P19784 6/20 0.55
CSNK2B P67870 6/20 0.55
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
TNF P01375 1/20 0.52
PIM1 P11309 2/20 0.51
PIM2 Q9P1W9 2/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.51
AURKA O14965 1/20 0.50
RHOA P61586 1/20 0.50
CHEK1 O14757 1/20 0.50
GAK O14976 1/20 0.50
DAPK3 O43293 1/20 0.50
DYRK3 O43781 1/20 0.50
ULK1 O75385 1/20 0.50
STK10 O94804 1/20 0.50
CCNB2 O95067 1/20 0.50

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
SCHEMBL29786964 1.00 CSNK2A1 (0.55) CSNK2A1CSNK2A2CSNK2BNPC1RAB9A
SCHEMBL20338702 0.87 TNF (0.51) CSNK2A1CSNK2A2CSNK2BNPC1RAB9A
SCHEMBL20338733 0.84 NPC1 (0.51) NPC1RAB9AALDH1A1KDM4EGAA
SCHEMBL29787028 0.84 NPC1 (0.51) NPC1RAB9AALDH1A1KDM4EGAA
SCHEMBL20338676 0.84 TNF (0.44) CSNK2A1CSNK2A2CSNK2BRAB9ATNF
SCHEMBL29787022 0.84 TNF (0.44) CSNK2A1CSNK2A2CSNK2BRAB9ATNF
SCHEMBL20356590 0.83 BTK (0.52) TNFAURKAMEN1KMT2A
SCHEMBL20338827 0.83 MAPT (0.59) NPC1RAB9ATNFALDH1A1KDM4E
SCHEMBL31240709 0.80 RAB9A (0.63) CSNK2A1CSNK2A2CSNK2BNPC1RAB9A
SCHEMBL17963877 0.80 TNF (0.44) NPC1RAB9ATNFTYK2GSK3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11440898-B2 Isoquinoline compounds, methods for their preparation, and therapeutic uses thereof in conditions associated with the alteration of the activity of beta galactosidase MINORYX THERAPEUTICS S.L. (ES) 2022-09-13 US disclosed
CN-110494432-B Isoquinoline compounds, methods of preparation thereof and therapeutic use thereof in disorders associated with altered beta-galactosidase activity 米尼奥尔克斯治疗有限公司 2022-08-12 CN disclosed
EP-3562821-B9 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S L (ES) 2021-05-26 EP disclosed
EP-3562821-B9 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S L (ES) 2021-05-26 EP disclosed
EP-3562821-B1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S L (ES) 2020-12-02 EP disclosed
EP-3562821-B1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S L (ES) 2020-12-02 EP disclosed
US-20200071294-A1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S.L. (ES) 2020-03-05 US disclosed
US-20200071294-A1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S.L. (ES) 2020-03-05 US disclosed
EP-3562821-A1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE Minoryx Therapeutics S.L. (ES) 2019-11-06 EP disclosed
WO-2018122746-A1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S.L. (ES) 2018-07-05 WO disclosed
WO-2018122746-A1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE MINORYX THERAPEUTICS S.L. (ES) 2018-07-05 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 (2 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-11440898-B2 Isoquinoline compounds, methods for their preparation, and therapeutic uses thereof in conditions associated with the alteration of the activity of beta galactosidase GLB1, GBA1, GALC CSNK2A1 701/4885CSNK2A2 815/4885CSNK2B 301/4885
US-20200071294-A1 ISOQUINOLINE COMPOUNDS, METHODS FOR THEIR PREPARATION, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF BETA GALACTOSIDASE GLB1, GBA1, GALC CSNK2A1 701/4885CSNK2A2 815/4885CSNK2B 301/4885

“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.