SCHEMBL1414834

SCHEMBL1414834

C=CCOC(=O)C1OC1CCCCCCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
POLB P06746 1/20 0.37
FASN P49327 1/20 0.37
TDP1 Q9NUW8 2/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
HPGD P15428 1/20 0.33
FAAH O00519 1/20 0.33
CNR1 P21554 1/20 0.33
DAGLA Q9Y4D2 1/20 0.33
CTSK P43235 1/20 0.33
SPHK2 Q9NRA0 3/20 0.32
SPHK1 Q9NYA1 3/20 0.32

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
SCHEMBL4913519 0.98 TSHR (0.47) TSHRPOLBFASNTDP1CTDSP1
SCHEMBL4912513 0.98 TSHR (0.47) TSHRPOLBFASNTDP1CTDSP1
SCHEMBL4206697 0.93 TSHR (0.44) TSHRPOLBTDP1FAAH
SCHEMBL28721283 0.90 ALOX5 (0.45) TSHRTDP1HPGD
SCHEMBL9133924 0.83 ALDH1A1 (0.43) TSHRPOLBFASNTDP1CTDSP1
SCHEMBL8823428 0.83 ALDH1A1 (0.43) TSHRPOLBFASNTDP1CTDSP1
SCHEMBL538472 0.81 NAAA (0.46) TSHRFAAHSPHK2SPHK1
SCHEMBL4732664 0.81 NAAA (0.42) TSHRPOLBFASNHPGD
SCHEMBL11396662 0.81 NAAA (0.46) TSHRFAAHSPHK2SPHK1
SCHEMBL1332659 0.81 NAAA (0.46) TSHRFAAHSPHK2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024084885-A1 RESIN COMPOSITION, METHOD FOR PRODUCING RESIN PRODUCT, AND FLAME RETARDANT MASTERBATCH 三菱ケミカル株式会社 2024-04-25 WO disclosed
CN-115746727-A Adhesive tape for water stop 富士胶片株式会社 2023-03-07 CN disclosed
CN-115674798-A Film and waterstop 富士胶片株式会社 2023-02-03 CN disclosed
CN-115674799-A Film and waterstop 富士胶片株式会社 2023-02-03 CN disclosed
EP-3431550-B1 FLAME RETARDANT THERMOPLASTIC POLYURETHANE RESIN COMPOSITION ADEKA CORP (JP) 2021-11-24 EP disclosed
EP-3255095-B1 FLAME-RETARDANT POLYOLEFIN RESIN COMPOSITION ADEKA CORP (JP) 2021-10-27 EP disclosed
EP-3255100-B1 FLAME-RETARDANT POLYPROPYLENE COMPOSITION ADEKA CORP (JP) 2021-08-18 EP disclosed
EP-3444300-B1 FLAME-RETARDANT POLYOLEFIN-BASED RESIN COMPOSITION ADEKA CORP (JP) 2020-11-18 EP disclosed
US-20200277316-A1 FLAME RETARDANT COMPOSITION, FLAME RETARDANT RESIN COMPOSITION CONTAINING SAID FLAME RETARDANT COMPOSITION, AND MOLDED BODY OF SAID FLAME RETARDANT RESIN COMPOSITION ADEKA CORPORATION (JP) 2020-09-03 US disclosed
US-10738159-B2 Flame retardant thermoplastic polyurethane resin composition ADEKA CORPORATION (JP) 2020-08-11 US disclosed
EP-1447428-B1 ONE PART MOISTURE CURING URETHANE COMPOSITION SUNSTAR ENGINEERING INC (JP) 2008-02-13 EP disclosed
EP-1792941-A1 RESIN COMPOSITION AND MOLDED ARTICLE COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2007-06-06 EP disclosed
CN-1308396-C One-pack type moisture-curable urethane composition SUNSTAR ENGINEERING INC (JP) 2007-04-04 CN disclosed
US-7148308-B2 One-part moisture-curing urethane composition SUNSTAR GIKEN KABUSHIKI KAISHA (JP) 2006-12-12 US disclosed
CN-1564849-A One-pack type moisture-curable urethane composition SUNSTAR ENGINEERING INC (JP) 2005-01-12 CN disclosed
US-20040238116-A1 One-part moisture-curing urethane composition SUNSTAR GIKEN KABUSHIKI KAISHA (JP) 2004-12-02 US disclosed
EP-1447428-A1 ONE PART MOISTURE CURING URETHANE COMPOSITION SUNSTAR GIKEN KABUSHIKI KAISHA (JP) 2004-08-18 EP disclosed
CN-1091786-C Plastisol composition GOODYEAR TIRE & RUBBER (US) 2002-10-02 CN disclosed
CN-1184136-A Plastisol composition GOODYEAR TIRE & RUBBER (US) 1998-06-10 CN disclosed
US-4865704-A HYDROXYL GROUP, AMINO GROUP CONTINING EPOXIDE RESIN, AND AMINO GROUP POLYMER BLEND HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-09-12 US 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 (1 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-20200277316-A1 FLAME RETARDANT COMPOSITION, FLAME RETARDANT RESIN COMPOSITION CONTAINING SAID FLAME RETARDANT COMPOSITION, AND MOLDED BODY OF SAID FLAME RETARDANT RESIN COMPOSITION RER1, FFAR1, AFF1 TSHR 1144/4885POLB 639/4885FASN 461/4885

“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.