SCHEMBL583879

SCHEMBL583879

C1CCC(N2CCCC2)C1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.56
L3MBTL3 Q96JM7 5/20 0.50
L3MBTL1 Q9Y468 5/20 0.50
PHGDH O43175 1/20 0.44
MGLL Q99685 1/20 0.44
MBTD1 Q05BQ5 1/20 0.44
SLC18A3 Q16572 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP2D6 P10635 3/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL127850 1.00 HTR6 (0.56) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL21422636 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL60131 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL2107230 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL728754 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL24782761 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL21057384 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL22216666 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL21057351 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL
SCHEMBL1828721 0.97 HTR6 (0.54) HTR6L3MBTL3L3MBTL1PHGDHMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117720517-A AR inhibitor, composition thereof and pharmaceutical application thereof 西藏海思科制药有限公司 2024-03-19 CN claimed
WO-2024012570-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 西藏海思科制药有限公司 2024-01-18 WO claimed
WO-2023232133-A1 COMPOUND FOR INHIBITING OR DEGRADING BCL6 AND USE THEREOF IN PHARMACEUTICS 西藏海思科制药有限公司 2023-12-07 WO claimed
CN-115703730-A Sulfonylurea compound, preparation method and application thereof 中国科学院上海药物研究所 2023-02-17 CN claimed
CN-114920746-A BTK (BTK inhibitory or degrading agent) and application thereof in medicine 四川海思科制药有限公司 2022-08-19 CN claimed
CN-108290055-B Oxime compounds as agonists of the muscle M1 and/or M4 receptor 赫普泰雅治疗有限公司 2021-05-14 CN claimed
EP-2318408-B1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMA (US) 2016-02-17 EP claimed
US-9193722-B2 Tri-cyclic pyrazolopyridine kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-11-24 US claimed
US-9137973-B2 Pyrazolopyridine kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-09-22 US claimed
EP-2778155-A1 2-aminopyridine derivatives useful as kinase inhibitors Vertex Pharmaceuticals Incorporated (US) 2014-09-17 EP claimed
US-20110077237-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-31 US claimed
WO-2010011772-A2 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-01-28 WO claimed
WO-2010011756-A1 PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-01-28 WO claimed
WO-2010011762-A1 PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-01-28 WO claimed
WO-2010011768-A1 TRI-CYCLIC PYRAZOLOPYRIDINE KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-01-28 WO claimed
EP-2121613-A2 2-AMINOPYRIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS Vertex Pharmaceuticals, Inc. (US) 2009-11-25 EP claimed
US-20090124602-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-05-14 US claimed
WO-2008094992-A2 2-AMINOPYRIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-08-07 WO claimed
US-20060035920-A1 Chk-1 inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-02-16 US claimed
WO-2005118583-A1 2, 5-DIHYDRO-PYRAZOLO`4, 3-C!QUINOLIN-4-ONES AS CHK-1 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-12-15 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20060035920-A1 Chk-1 inhibitors CHKA, CHKB, CHEK1 HTR6 3259/4885L3MBTL3 1696/4885L3MBTL1 733/4885
US-20090124602-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 HTR6 3265/4885L3MBTL3 2612/4885L3MBTL1 2582/4885
US-20110077237-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 HTR6 3265/4885L3MBTL3 2612/4885L3MBTL1 2582/4885

“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.