SCHEMBL6945700

SCHEMBL6945700

O=C(O)OCC1CCCO1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.67
LMNA P02545 2/20 0.66
POLB P06746 1/20 0.66
NPSR1 Q6W5P4 1/20 0.52
HTT P42858 1/20 0.46
MGLL Q99685 2/20 0.46

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
SCHEMBL15135511 0.94 ALDH1A1 (0.60) ALDH1A1LMNAPOLBMGLL
SCHEMBL1469483 0.86 LMNA (0.68) ALDH1A1LMNAPOLBNPSR1
SCHEMBL10290385 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1
SCHEMBL4669286 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1
SCHEMBL6443856 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1
SCHEMBL23049101 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1
SCHEMBL118897 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1
SCHEMBL8845308 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1
SCHEMBL1068467 0.82 ALDH1A1 (0.87) ALDH1A1LMNAPOLBNPSR1MGLL
SCHEMBL17269992 0.82 LMNA (0.64) ALDH1A1LMNAPOLBNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230058729-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2023-02-23 US disclosed
CN-115003756-A Resin composition 松下知识产权经营株式会社 2022-09-02 CN disclosed
US-11136327-B2 Macrocycles as factor XIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-10-05 US disclosed
WO-2021152973-A1 RESIN COMPOSITION パナソニックIPマネジメント株式会社 2021-08-05 WO disclosed
EP-3786165-A1 SYNTHETIC INTERMEDIATES FOR PRODUCING MACROCYCLES AS FACTOR XIA INHIBITORS Bristol-Myers Squibb Company (US) 2021-03-03 EP disclosed
EP-2534154-B1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-08-05 EP disclosed
US-20200087312-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL MYERS SQUIBB (US) 2020-03-19 US disclosed
US-20180022753-A1 MACROCYCLES AS FACTOR XIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-01-25 US disclosed
US-9802939-B2 Macrocycles as factor XIa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-10-31 US disclosed
US-9231274-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-05 US disclosed
EP-0973768-A1 AZOLE COMPOUNDS, THEIR PRODUCTION AND THEIR USE Takeda Chemical Industries, Ltd. (JP) 2000-01-26 EP disclosed
US-5922443-A Polymeric article, such as a medical catheter, and method for making the same BOSTON SCIENTIFIC GLENS FALLS CORP. 1999-07-13 US disclosed
WO-1998043970-A1 AZOLE COMPOUNDS, THEIR PRODUCTION AND THEIR USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-08 WO disclosed
EP-0514913-B1 A polymeric article, such as a medical catheter, and method for making the same NAMIC CARIBE INC (PR) 1997-03-12 EP disclosed
US-5484565-A Method for making a medical catheter NAMIC CARIBE, INC. (PR) 1996-01-16 US disclosed
EP-0514913-A2 A polymeric article, such as a medical catheter, and method for making the same NAMIC CARIBE, INC. (PR) 1992-11-25 EP disclosed
EP-0257274-B1 PROCESS FOR THE ANTISTATIC PRETREATMENT OF POLYAMIDES/POLYIMIDES, THE SO TREATED PRODUCTS AND THEIR USE BAYER AG (DE) 1991-08-21 EP disclosed
US-4861663-A Process for antistatic treatment or pretreatment of polyamides, polyimides, antistatically treated or pretreated materials, and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 1989-08-29 US disclosed
EP-0257274-A2 Process for the antistatic pretreatment of polyamides/polyimides, the so treated products and their use BAYER AG (DE) 1988-03-02 EP disclosed
EP-0058331-B1 POLYAMIDE MOULDING COMPOUNDS BAYER AG (DE) 1985-06-12 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 (4 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-20200087312-A1 MACROCYCLES AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 ALDH1A1 4598/4885LMNA 1757/4885POLB 4561/4885
US-11136327-B2 Macrocycles as factor XIA inhibitors TFPI, TFPI2, F11 ALDH1A1 4598/4885LMNA 1757/4885POLB 4561/4885
US-20180022753-A1 MACROCYCLES AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 ALDH1A1 4598/4885LMNA 1757/4885POLB 4561/4885
US-20230058729-A1 MACROCYCLES AS FACTOR XIA INHIBITORS TFPI, TFPI2, F11 ALDH1A1 4598/4885LMNA 1757/4885POLB 4561/4885

“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.