SCHEMBL736886

SCHEMBL736886

[CH]1CC(N2CCOCC2)C1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 3/20 0.38
CYP2A13 Q16696 1/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
L3MBTL3 Q96JM7 1/20 0.37
OPRL1 P41146 2/20 0.36
KDM4E B2RXH2 1/20 0.34
KDM1A O60341 1/20 0.33
MAOB P27338 1/20 0.33
ACHE P22303 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MGLL Q99685 1/20 0.32
EPHX2 P34913 1/20 0.32
MAPT P10636 1/20 0.31
KDM2B Q8NHM5 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31

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
SCHEMBL738620 0.83 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1CYP2A13HPGDL3MBTL1
SCHEMBL737575 0.78 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1CYP2A13HPGDL3MBTL1
SCHEMBL738738 0.75 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1CYP2A13HPGDL3MBTL1
SCHEMBL737061 0.75
SCHEMBL3168997 0.75
SCHEMBL23581363 0.75
SCHEMBL26112778 0.75 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1CYP2A13HPGDL3MBTL1
SCHEMBL26112782 0.75 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1CYP2A13HPGDL3MBTL1
SCHEMBL14862483 0.72 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1CYP2A13HPGDL3MBTL1
SCHEMBL735494 0.72 FYN (0.41) ALDH1A1L3MBTL1L3MBTL3OPRL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110099899-B Oxazole derivatives useful as IRAK inhibitors and process for their preparation 里格尔药品股份有限公司 2024-01-02 CN claimed
US-11612606-B2 8-aminoisoquinoline compounds and uses thereof GENENTECH, INC. (US) 2023-03-28 US claimed
EP-3532470-B1 OXAZOLE DERIVATIVES FOR USE AS IRAK INHIBITORS AND METHOD FOR THEIR PREPARATION RIGEL PHARMACEUTICALS INC (US) 2022-12-07 EP claimed
US-20200291018-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS, INC. (US) 2020-09-17 US claimed
EP-3652174-A1 TAM KINASE INHIBITORS Syros Pharmaceuticals, Inc. (US) 2020-05-20 EP claimed
EP-3532470-A1 OXAZOLE DERIVATIVES FOR USE AS IRAK INHIBITORS AND METHOD FOR THEIR PREPARATION Rigel Pharmaceuticals, Inc. (US) 2019-09-04 EP claimed
WO-2019014513-A1 TAM KINASE INHIBITORS SYROS PHARMACEUTICALS, INC. (US) 2019-01-17 WO claimed
WO-2018089199-A1 OXAZOLE DERIVATIVES FOR USE AS IRAK INHIBITORS AND METHOD FOR THEIR PREPARATION RIGEL PHARMACEUTICALS, INC. (US) 2018-05-17 WO claimed
US-11993594-B2 IRAK inhibitors and method for making and using RIGEL PHARMACEUTICALS, INC. (US) 2024-05-28 US disclosed
CN-110099899-B Oxazole derivatives useful as IRAK inhibitors and process for their preparation 里格尔药品股份有限公司 2024-01-02 CN disclosed
US-11612606-B2 8-aminoisoquinoline compounds and uses thereof GENENTECH, INC. (US) 2023-03-28 US disclosed
US-20230062818-A1 IRAK INHIBITORS AND METHOD FOR MAKING AND USING RIGEL PHARMACEUTICALS, INC. (US) 2023-03-02 US disclosed
EP-3860980-A1 8-AMINOISOQUINOLINE COMPOUNDS AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2021-08-11 EP disclosed
US-20210179601-A1 IRAK INHIBITORS AND METHOD FOR MAKING AND USING RIGEL PHARMACEUTICALS, INC. (US) 2021-06-17 US disclosed
EP-1944301-A1 NOVEL BENZOXATHIIN DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-07-16 EP disclosed
EP-1892241-A1 NOVEL PIPERIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-02-27 EP disclosed
US-20070167453-A1 Nitrogenous fused heteroaromatic ring derivative MSD K.K. (JP) 2007-07-19 US disclosed
EP-1719756-A1 NITROGENOUS FUSED HETEROAROMATIC RING DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-08 EP disclosed
EP-1717230-A1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-02 EP disclosed
US-20050182045-A1 Fused ring 4-oxopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-08-18 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 (7 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-20200291018-A1 TAM KINASE INHIBITORS MAP3K1, PIK3CA, MAP3K5 SMN1; SMN2 4614/4885ALDH1A1 3392/4885CYP2A13 4536/4885
US-20050182045-A1 Fused ring 4-oxopyrimidine derivative HRH4, HRH2, HRH3 SMN1; SMN2 2278/4885ALDH1A1 1717/4885CYP2A13 946/4885
US-20210179601-A1 IRAK INHIBITORS AND METHOD FOR MAKING AND USING IRAK1, IRAK2, IRAK3 SMN1; SMN2 1182/4885ALDH1A1 1451/4885CYP2A13 4393/4885
US-20070167453-A1 Nitrogenous fused heteroaromatic ring derivative HRH3, HRH2, HRH4 SMN1; SMN2 2656/4885ALDH1A1 1934/4885CYP2A13 505/4885
US-11993594-B2 IRAK inhibitors and method for making and using IRAK1, IRAK2, IRAK3 SMN1; SMN2 1182/4885ALDH1A1 1451/4885CYP2A13 4393/4885
US-20230062818-A1 IRAK INHIBITORS AND METHOD FOR MAKING AND USING IRAK1, IRAK2, IRAK3 SMN1; SMN2 1182/4885ALDH1A1 1451/4885CYP2A13 4393/4885
US-11612606-B2 8-aminoisoquinoline compounds and uses thereof PHKG1, MAP4K5, HIPK1 SMN1; SMN2 3099/4885ALDH1A1 3407/4885CYP2A13 3858/4885

“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.