SCHEMBL4064503

SCHEMBL4064503

C#CC1C2CC3CC(C2)CC1C3

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL10457153 0.73 CYP2C9 (0.42) CYP2C9
SCHEMBL1726623 0.69 CYP2C9 (0.38) CYP2C9
SCHEMBL12420559 0.69 CYP2C9 (0.38) CYP2C9
SCHEMBL12508912 0.69 CYP2C9 (0.38) CYP2C9
SCHEMBL871897 0.69 CYP2C9 (0.38) CYP2C9HSD17B10L3MBTL1
SCHEMBL5145782 0.65
SCHEMBL631518 0.63 EPHX2 (0.41) CYP2C9HSD17B10L3MBTL1
SCHEMBL11033574 0.62 CYP2C9 (0.44) CYP2C9
Adamantane SCHEMBL28785912 0.62 CYP2C9 (0.40) CYP2C9
Adamantane SCHEMBL1527414 0.61 CYP2C9 (0.46) CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0607334-B1 CYCLIC UREAS AND ANALOGUES USEFUL AS RETROVIRAL PROTEASE INHIBITIORS DU PONT MERCK PHARMA (US) 1997-07-30 EP claimed
CN-115551504-B Novel pharmacological chaperones of human acid alpha-glucosidase and therapeutic uses thereof 格勒诺布尔-阿尔卑斯大学 2024-12-13 CN disclosed
US-20230339856-A1 NOVEL PHARMACOLOGICAL CHAPERONE COMPOUNDS OF HUMAN ACID ALPHA-GLUCOSIDASE AND THE THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-10-26 US disclosed
EP-4138827-A1 NOVEL PHARMACOLOGICAL CHAPERONE COMPOUNDS OF HUMAN ACID ALPHA-GLUCOSIDASE AND THE THERAPEUTIC USE THEREOF Université Grenoble Alpes (FR) 2023-03-01 EP disclosed
WO-2021214245-A1 NOVEL PHARMACOLOGICAL CHAPERONE COMPOUNDS OF HUMAN ACID ALPHA-GLUCOSIDASE AND THE THERAPEUTIC USE THEREOF UNIVERSITÉ GRENOBLE ALPES (FR) 2021-10-28 WO disclosed
US-20090030248-A1 Ethynylphenylbiadamantane derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-01-29 US disclosed
EP-2014636-A1 Ethynylphenylbiadamantane derivatives Daicel Chemical Industries, Ltd. (JP) 2009-01-14 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 (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-20090030248-A1 Ethynylphenylbiadamantane derivatives CHRNA5, CHRNE, ADRA1D CYP2C9 271/4885HSD17B10 1922/4885L3MBTL1 3002/4885
US-20230339856-A1 NOVEL PHARMACOLOGICAL CHAPERONE COMPOUNDS OF HUMAN ACID ALPHA-GLUCOSIDASE AND THE THERAPEUTIC USE THEREOF GAA, GBA3, GANAB CYP2C9 3849/4885HSD17B10 2056/4885L3MBTL1 3724/4885

“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.