SCHEMBL737575

SCHEMBL737575

[CH]1CCCC(N2CCOCC2)C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
L3MBTL3 Q96JM7 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
OPRL1 P41146 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HRH3 Q9Y5N1 3/20 0.32
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32
MAP4K4 O95819 1/20 0.32
HPGD P15428 2/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP2A13 Q16696 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
KDM4E B2RXH2 1/20 0.30

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 0.90 SMN1; SMN2 (0.42) SMN1; SMN2L3MBTL3L3MBTL1OPRL1HRH3
SCHEMBL737435 0.83 L3MBTL3 (0.39) L3MBTL3L3MBTL1
SCHEMBL735624 0.81 L3MBTL3 (0.38) L3MBTL3L3MBTL1MEN1KMT2A
SCHEMBL736038 0.81 L3MBTL3 (0.38) L3MBTL3L3MBTL1MEN1KMT2A
SCHEMBL736517 0.81 L3MBTL3 (0.38) L3MBTL3L3MBTL1MEN1KMT2A
SCHEMBL2064673 0.79
SCHEMBL738738 0.79 SMN1; SMN2 (0.48) SMN1; SMN2L3MBTL3L3MBTL1OPRL1KDM1A
SCHEMBL736886 0.78 SMN1; SMN2 (0.42) SMN1; SMN2L3MBTL3L3MBTL1OPRL1MEN1
SCHEMBL3598906 0.76 L3MBTL3 (0.34) L3MBTL3L3MBTL1HRH3ALDH1A1KDM4E
SCHEMBL1827648 0.75 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL3L3MBTL1OPRL1HRH3

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-11993594-B2 IRAK inhibitors and method for making and using RIGEL PHARMACEUTICALS, INC. (US) 2024-05-28 US disclosed
EP-4351552-A1 COMBINATION THERAPIES WITH SETD2 INHIBITORS Epizyme, Inc. (US) 2024-04-17 EP disclosed
CN-117794543-A Combination therapy with SETD2 inhibitors EPIZYME股份有限公司 2024-03-29 CN 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-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES Epizyme, Inc. (US) 2023-05-04 US disclosed
US-20230075198-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF Epizyme, Inc. 2023-03-09 US disclosed
US-20230062818-A1 IRAK INHIBITORS AND METHOD FOR MAKING AND USING RIGEL PHARMACEUTICALS, INC. (US) 2023-03-02 US disclosed
EP-4107157-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES Epizyme, Inc. (US) 2022-12-28 EP disclosed
WO-2022261243-A1 COMBINATION THERAPIES WITH SETD2 INHIBITORS Epizyme, Inc. (US) 2022-12-15 WO disclosed
EP-3532470-B1 OXAZOLE DERIVATIVES FOR USE AS IRAK INHIBITORS AND METHOD FOR THEIR PREPARATION RIGEL PHARMACEUTICALS INC (US) 2022-12-07 EP 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
US-5272268-A Dipeptide derivatives SHIONOGI & CO., LTD. (JP) 1993-12-21 US disclosed
US-5223615-A Hypotensive agents SHIONOGI & CO., LTD. (JP) 1993-06-29 US disclosed
US-5194608-A Hypotensive agents; inhibits renin-angiotensin system SHIONOGI & CO., LTD. (JP) 1993-03-16 US disclosed
EP-0468641-A2 Renin inhibiting dipeptide derivatives, their preparation and pharmaceutical preparations containing them SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1992-01-29 EP 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-20050182045-A1 Fused ring 4-oxopyrimidine derivative HRH4, HRH2, HRH3 SMN1; SMN2 2278/4885L3MBTL3 3251/4885L3MBTL1 2929/4885
US-20230075198-A1 SUBSTITUTED INDOLES AND METHODS OF USE THEREOF FOXM1, CCNE2, CCNE1 SMN1; SMN2 1096/4885L3MBTL3 491/4885L3MBTL1 640/4885
US-20070167453-A1 Nitrogenous fused heteroaromatic ring derivative HRH3, HRH2, HRH4 SMN1; SMN2 2656/4885L3MBTL3 2714/4885L3MBTL1 2263/4885
US-11993594-B2 IRAK inhibitors and method for making and using IRAK1, IRAK2, IRAK3 SMN1; SMN2 1182/4885L3MBTL3 2060/4885L3MBTL1 1474/4885
US-20230133671-A1 SETD2 INHIBITORS AND RELATED METHODS AND USES, INCLUDING COMBINATION THERAPIES EZH2, HDAC2, SETD2 SMN1; SMN2 2240/4885L3MBTL3 2533/4885L3MBTL1 2157/4885
US-20230062818-A1 IRAK INHIBITORS AND METHOD FOR MAKING AND USING IRAK1, IRAK2, IRAK3 SMN1; SMN2 1182/4885L3MBTL3 2060/4885L3MBTL1 1474/4885

“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.