SCHEMBL1231245

SCHEMBL1231245

CC1(C)CC(N=C=O)CC(C)(CN=C=O)C1.O=C=NCCCCCCN=C=O

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.83
CYP3A4 P08684 1/20 0.83

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
SCHEMBL27085118 1.00 ALDH1A1 (0.83) ALDH1A1CYP3A4
SCHEMBL3331827 0.99 ALDH1A1 (0.86) ALDH1A1CYP3A4
SCHEMBL28174008 0.96 ALDH1A1 (0.86) ALDH1A1CYP3A4
SCHEMBL15234191 0.92 ALDH1A1 (0.79) ALDH1A1CYP3A4
SCHEMBL15846 0.91 ALDH1A1 (1.00) ALDH1A1CYP3A4
SCHEMBL28910450 0.91 ALDH1A1 (1.00) ALDH1A1CYP3A4
SCHEMBL6836764 0.91 ALDH1A1 (1.00) ALDH1A1CYP3A4
SCHEMBL29932997 0.91 ALDH1A1 (1.00) ALDH1A1CYP3A4
SCHEMBL30393565 0.91 ALDH1A1 (1.00) ALDH1A1CYP3A4
SCHEMBL5610404 0.91 ALDH1A1 (1.00) ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115849999-B Hydrocarbon fuel-rich propellant and preparation method thereof 湖北航天化学技术研究所 2023-12-08 CN claimed
CN-115849999-A Hydrocarbon fuel-rich propellant and preparation method thereof 湖北航天化学技术研究所 2023-03-28 CN claimed
US-20170275430-A1 COMPOSITE SEMI-FINISHED PRODUCTS, MOLDED PARTS PRODUCED THEREFROM, AND DIRECTLY PRODUCED MOLDED PARTS BASED ON HYDROXY-FUNCTIONALIZED (METH)ACRYLATES AND URETDIONES THAT ARE CROSS-LINKED IN A THERMOSETTING MANNER EVONIK DEGUSSA GMBH (DE) 2017-09-28 US claimed
US-20130101858-A1 LOW DIELECTRIC CONSTANT RESIN FORMULATION, PREPOLYMER, COMPOSITION, AND COMPOSITE THEREOF INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-04-25 US claimed
EP-1332045-B1 SEAMLESS MODEL AND METHOD OF MAKING A SEAMLESS MODEL HUNTSMAN ADV MAT SWITZERLAND (CH) 2004-10-20 EP claimed
US-5750129-A SOLID RESERVOIRS ENCAPSULATED WITH POROUS MEMBRANE PHERO TECH INC. (CA) 1998-05-12 US claimed
EP-0102720-B1 POLYURETHANE COATING OR ADHESIVE COMPOSITIONS AND METHODS OF USING THEM ROHM AND HAAS COMPANY (US) 1988-07-13 EP claimed
US-20240117211-A1 PAINT COMPOSITION HAVING IMPROVED ANTIBACTERIAL PROPERTIES FOR WATER TRANSFER PRINTING HYUNDAI MOTOR COMPANY (KR) 2024-04-11 US disclosed
EP-4342927-A1 POLYURETHANE RESIN COMPOSITION, CURED PRODUCT, ARTIFICIAL LEATHER, SYNTHETIC LEATHER, AND SURFACE TREATMENT AGENT FOR LEATHER Tosoh Corporation (JP) 2024-03-27 EP disclosed
US-11332642-B2 Assembly layer for flexible display 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-05-17 US disclosed
US-20220106497-A1 RADICAL CURABLE ANTI-FOG COATINGS SDC TECHNOLOGIES, INC. 2022-04-07 US disclosed
CN-107683313-B Component layer for flexible displays 3M创新有限公司 2021-02-05 CN disclosed
US-10843045-B2 Golf ball BRIDGESTONE SPORTS CO., LTD. (JP) 2020-11-24 US disclosed
US-5116528-A LIGHT MODULATING MATERIAL INCLUDING LIQUID CRYSTALLINE MATERIAL MULLEN PATRICK (US) 1992-05-26 US disclosed
WO-1991013126-A1 A LIGHT MODULATING MATERIAL INCLUDING LIQUID CRYSTALLINE MATERIAL PEREGRINE OPTIFILM, INC. (US) 1991-09-05 WO disclosed
US-4933417-A POLYESTER OR POLYACTONE ENDCAPPED WITH A DIISOCYANATE AND FURTHER REACTED WITH AMINO COMPOUND NIPPON OIL AND FATS CO., LTD. (JP) 1990-06-12 US disclosed
US-4835027-A Optical disc HITACHI, LTD. (JP) 1989-05-30 US disclosed
US-4456738-A LOW-MOLECULAR-WEIGHT HIGH-SOLIDS AUTOMOBILE PRIMERS; PROTECTIVE COATINGS FORD MOTOR COMPANY (US) 1984-06-26 US disclosed
US-4456740-A LOW-MOLECULAR-WEIGHT HIGH-SOLIDS FOR AUTOMOBILE PRIMERS; PROTECTIVE COATINGS FORD MOTOR COMPANY (US) 1984-06-26 US disclosed
US-4410679-A Coating composition comprising chain-extendable crosslinkable polyol and diblocked diisocyanate diurethane oligomer FORD MOTOR COMPANY (US) 1983-10-18 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-20130101858-A1 LOW DIELECTRIC CONSTANT RESIN FORMULATION, PREPOLYMER, COMPOSITION, AND COMPOSITE THEREOF PUF60, PRPF40A, PARN ALDH1A1 1146/4885CYP3A4 3733/4885

“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.