SCHEMBL128747

SCHEMBL128747

[CH2]C(C)C(=O)OCCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
TSHR P16473 5/20 0.52
HPGD P15428 2/20 0.52
ATM Q13315 1/20 0.50
HCAR2 Q8TDS4 1/20 0.44
NAAA Q02083 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
EPHX1 P07099 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.40
ESR1 P03372 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 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
SCHEMBL4448631 0.91 NAAA (0.55) ALDH1A1TSHRHCAR2NAAAEPHX1
SCHEMBL129854 0.86
SCHEMBL5871733 0.84 ALDH1A1 (0.56) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL9442346 0.82 ALDH1A1 (0.54) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL407053 0.81 ALDH1A1 (0.58) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL3678999 0.81 ALDH1A1 (0.58) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL6747488 0.81 ALDH1A1 (0.58) ALDH1A1TSHRHPGDATMHCAR2
Formaldehyde SCHEMBL25434604 0.80 ALDH1A1 (0.52) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL128060 0.80 ALDH1A1 (0.52) ALDH1A1TSHRHPGDATMHCAR2
SCHEMBL6900341 0.80 ALDH1A1 (0.52) ALDH1A1TSHRHPGDATMHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7858802-B2 Method of preparing ionic liquids BASF SE (DE) 2010-12-28 US claimed
WO-2024149635-A1 BRANCHED AMINES AS ADDITIVES FOR GASOLINE FUELS BASF SE (DE) 2024-07-18 WO disclosed
US-20240240095-A1 NEW COMPOSITIONS FOR REDUCING CRYSTALLIZATION OF PARAFFIN CRYSTALS IN FUELS BASF SE (DE) 2024-07-18 US disclosed
US-20240217923-A1 A DIISOCYANATE STABILIZER, USE THEREOF, AND DIISOCYANATE COMPOSITION BASF (CHINA) COMPANY LIMITED (CN) 2024-07-04 US disclosed
CN-118251435-A Preparation and use of polyisocyanates containing iminooxadiazinedione groups 巴斯夫欧洲公司 2024-06-25 CN disclosed
CN-115175967-B Ionic liquids for stabilizing viscosity of silicate-based coatings 巴斯夫欧洲公司 2024-06-14 CN disclosed
EP-4382588-A1 ADDITIVES FOR IMPROVING THERMAL STABILITY OF FUELS BASF SE (DE) 2024-06-12 EP disclosed
CN-118119689-A Reduction of asphaltenes from marine fuels 巴斯夫欧洲公司 2024-05-31 CN disclosed
CN-118119688-A Reduction of asphaltenes from marine fuels 巴斯夫欧洲公司 2024-05-31 CN disclosed
CN-112673012-B Multifunctional bisacylphosphine oxide photoinitiator 意大利艾坚蒙树脂有限公司 2024-05-24 CN disclosed
US-5218009-A Photoinitiators for the photopolymerization of ethylenically unsaturated compounds CIBA-GEIGY CORPORATION (US) 1993-06-08 US disclosed
EP-0502816-A1 Coating compositions resistant to light deterioration CIBA-GEIGY AG (CH) 1992-09-09 EP disclosed
US-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
EP-0413657-A2 Mono- and diacyl phosphine oxides CIBA-GEIGY AG (CH) 1991-02-20 EP disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
EP-0138754-B1 PHOTOCURABLE COMPOSITIONS CIBA-GEIGY AG (CH) 1988-05-25 EP disclosed
EP-0138754-A2 Photocurable compositions CIBA-GEIGY AG (CH) 1985-04-24 EP disclosed
EP-0031295-B1 ORGANIC ANTIMONY-SULPHUR COMPOUNDS, THEIR USE AS STABILISERS IN CHLORIC THERMOPLASTICS, AND THERMOPLASTICS SO STABILISED CIBA-GEIGY AG (CH) 1983-05-18 EP disclosed
US-4367304-A Novel organic antimony-sulfur compounds and their use as stabilizers for chlorine-containing thermoplasts CIBA-GEIGY CORPORATION (US) 1983-01-04 US disclosed
EP-0031295-A1 Organic antimony-sulphur compounds, their use as stabilisers in chloric thermoplastics, and thermoplastics so stabilised CIBA-GEIGY AG (CH) 1981-07-01 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 (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-20240217923-A1 A DIISOCYANATE STABILIZER, USE THEREOF, AND DIISOCYANATE COMPOSITION TST, DDT, PAH ALDH1A1 1578/4885TSHR 2772/4885HPGD 1185/4885

“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.