SCHEMBL1788313

SCHEMBL1788313

O=C(O)CC12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.66
ALDH1A1 P00352 4/20 0.51
TSHR P16473 1/20 0.51
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
THRB P10828 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PKM P14618 1/20 0.42
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HSD11B1 P28845 1/20 0.40

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
SCHEMBL14433714 0.88 POLB (0.75) POLBALDH1A1TSHRLMNAGAA
SCHEMBL14493662 0.88 POLB (0.75) POLBALDH1A1TSHRLMNAGAA
SCHEMBL29838840 0.88 POLB (0.75) POLBALDH1A1TSHRLMNAGAA
SCHEMBL1058665 0.88 POLB (0.75) POLBALDH1A1TSHRLMNAGAA
SCHEMBL13589979 0.88 POLB (0.75) POLBALDH1A1TSHRLMNAGAA
SCHEMBL17818866 0.83 POLB (0.50) POLBALDH1A1TSHRGAATHRB
SCHEMBL6865696 0.82 POLB (0.68) POLBALDH1A1TSHRLMNAGAA
SCHEMBL1089318 0.82 POLB (0.46) POLBALDH1A1TSHRLMNAGAA
SCHEMBL23406969 0.79 POLB (0.64) POLBALDH1A1TSHRLMNAGAA
SCHEMBL503339 0.79 POLB (0.64) POLBALDH1A1TSHRLMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010965-A Photochromic spiropyran derivative containing adamantyl group and preparation method and application thereof 安徽师范大学 2026-05-12 CN claimed
CN-117467249-A Anti-irradiation fruit fresh-keeping film and preparation method thereof 台州鸿博辐照科技有限公司 2024-01-30 CN claimed
CN-117070138-A Quick-drying alkyd resin paint and preparation method thereof 山东齐鲁漆业有限公司 2023-11-17 CN claimed
CN-116410092-A Idebenone derivative, preparation method and application thereof 山东大学齐鲁医院(青岛) 2023-07-11 CN claimed
CN-122010965-A Photochromic spiropyran derivative containing adamantyl group and preparation method and application thereof 安徽师范大学 2026-05-12 CN disclosed
CN-119036431-A Ion driver containing ion channel interface and preparation method thereof 苏州大学 2024-11-29 CN disclosed
CN-117467249-A Anti-irradiation fruit fresh-keeping film and preparation method thereof 台州鸿博辐照科技有限公司 2024-01-30 CN disclosed
CN-117070138-A Quick-drying alkyd resin paint and preparation method thereof 山东齐鲁漆业有限公司 2023-11-17 CN disclosed
CN-116410092-A Idebenone derivative, preparation method and application thereof 山东大学齐鲁医院(青岛) 2023-07-11 CN disclosed
CN-112384489-A Method for producing organic compound 尤尼吉可株式会社 2021-02-19 CN disclosed
CN-109694417-B Simple and efficient purification and recovery method of pipeline crystalline alpha-and gamma-cyclodextrin crystals 北京理工大学 2021-01-08 CN disclosed
WO-2020009016-A1 METHOD FOR PRODUCING ORGANIC COMPOUND ユニチカ株式会社 2020-01-09 WO disclosed
WO-2011066168-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-06-03 WO disclosed
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-05-26 US disclosed
US-20100291642-A1 Process For Preparing Dipeptidyl Peptidase IV Inhibitors And Intermediates Therefor BRISTOL-MYERS SQUIBB COMPANY (US) 2010-11-18 US disclosed
US-7741082-B2 Process for preparing dipeptidyl peptidase IV inhibitors and intermediates therefor BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-22 US disclosed
US-20050260712-A1 Process for preparing dipeptidyl peptidase IV inhibitors and intermediates therefor ASTRAZENECA AB (SE) 2005-11-24 US disclosed
US-6348625-B1 TREATING CORRESPONDING CARBOXYLIC ACID FUNCTIONAL GROUP WITH N,N-DIETHYL-1,1,2,3,3,3-HEXAFLUOROPROPYLAMINE FOLLOWED BY AMMONIA ANDERSON GLORIA LONG (US) 2002-02-19 US disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 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-20050260712-A1 Process for preparing dipeptidyl peptidase IV inhibitors and intermediates therefor DNPEP, DPP4, PEPD POLB 1051/4885ALDH1A1 377/4885TSHR 2534/4885
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNQ3 POLB 4381/4885ALDH1A1 1644/4885TSHR 1471/4885

“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.