SCHEMBL1493050

SCHEMBL1493050

CC1CCC(N=C=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
APLNR P35414 1/20 0.38
CYP3A4 P08684 1/20 0.36
EPHX1 P07099 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL1992984 1.00 ALDH1A1 (0.56) ALDH1A1APLNRCYP3A4EPHX1HIF1A
SCHEMBL28120055 0.93 ALDH1A1 (0.50) ALDH1A1APLNRCYP3A4
SCHEMBL9439902 0.93 ALDH1A1 (0.50) ALDH1A1APLNRCYP3A4
SCHEMBL28853844 0.93 ALDH1A1 (0.50) ALDH1A1APLNRCYP3A4
SCHEMBL21065562 0.93 ALDH1A1 (0.50) ALDH1A1APLNRCYP3A4
SCHEMBL150431 0.91 ALDH1A1 (0.74) ALDH1A1APLNRCYP3A4EPHX1HIF1A
SCHEMBL20782935 0.91 ALDH1A1 (0.60) ALDH1A1APLNRCYP3A4EPHX1HIF1A
Cyanate SCHEMBL28834574 0.89 ALDH1A1 (0.46) ALDH1A1APLNRCYP3A4
SCHEMBL12892708 0.87 ALDH1A1 (0.45) ALDH1A1APLNRCYP3A4
SCHEMBL21378 0.86 ALDH1A1 (0.72) ALDH1A1APLNRCYP3A4EPHX1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3559069-B9 POLYURETHANE PREPOLYMERS INCORPORATING NONLINEAR SHORT CHAIN DIOLS AND/OR SOFT DIISOCYANATES COMPOSITIONS, AND USES THEREOF PRC DESOTO INT INC (US) 2024-10-23 EP claimed
EP-3559069-B1 POLYURETHANE PREPOLYMERS INCORPORATING NONLINEAR SHORT CHAIN DIOLS AND/OR SOFT DIISOCYANATES COMPOSITIONS, AND USES THEREOF PRC DESOTO INT INC (US) 2024-08-14 EP claimed
CN-112061593-B Multilayer protection inflatable packaging bag with self-adhesive film 潮州市潮安区国强印务有限公司 2024-07-23 CN claimed
CN-117801688-A Flexible adhesive material and preparation method thereof 南通市锋芒复合材料科技有限公司 2024-04-02 CN claimed
CN-117295775-A Adhesive agent 科思创德国股份有限公司 2023-12-26 CN claimed
CN-113866329-B Method for detecting isocyanate potential genotoxic impurities in glimepiride tablets 贵州天安药业股份有限公司 2023-08-29 CN claimed
CN-106489818-B Oxygenation medicine is shed all-in-one for pond 淮安市绿泉工贸有限公司 2022-09-23 CN claimed
CN-113866329-A Method for detecting isocyanate potential genotoxicity impurities in glimepiride tablet 贵州天安药业股份有限公司 2021-12-31 CN claimed
US-20210139737-A1 AQUEOUS COATING COMPOSITION FOR SIDE SEAM STRIP OR SIDE SEAM COATING ON THREE-PIECE CAN GUANGDONG HUARUN PAINTS CO. LTD. (CN) 2021-05-13 US claimed
CN-112210323-A Pressure stimulation response self-adhesive film material for inflatable packaging bag and preparation method thereof 杭州空气盒子包装有限公司 2021-01-12 CN claimed
US-7132444-B2 Process for the preparation of trans-3-ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(4-methyl cyclohexyl) amino]carbonyl]amino]sulfonyl] phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide SUN PHARMACEUTICAL INDUSTRIES, LTD. (IN) 2006-11-07 US claimed
CN-1842554-A Method for preparing polyurethane aqueous dispersion by flash evaporation DEGUSSA (DE) 2006-10-04 CN claimed
CN-1232554-C Coating consisting of special polyols and oxalic acid BAYER AG (DE) 2005-12-21 CN claimed
US-20050070593-A1 Novel process for the preparation of trans-3-ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(4-methyl cyclohexyl) amino]carbonyl] amino]sulfonyl] phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide SUN PHARMACEUTICAL INDUSTRIES, LTD. (IN) 2005-03-31 US claimed
CN-1167725-C Branch-like and high branching polyurethane �����ɷ� 2004-09-22 CN claimed
CN-1521162-A Process for the synthesis of p-methyl cyclohexyl isocyanate 成都摩尔生物医药有限公司 2004-08-18 CN claimed
WO-2003057131-A2 NOVEL PROCESS FOR THE PREPARATION OF TRANS-3- ETHYL-2,5- DIHYDRO-4- METHYL-N-[2-[ 4-[[[[(4-METHYL CYCLOHEXYL) AMINO]CARBONYL] AMINO]SULFONYL] PHENYL]ETHYL] -2-OXO-1H-PYRROLE -1-CARBOXAMIDE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2003-07-17 WO claimed
CN-1264716-A Branch-like and high branching polyurethane BASF AG (DE) 2000-08-30 CN claimed
CN-1167773-A Method of producing isocyanate-modified latex polymer ROHM & HAAS (US) 1997-12-17 CN claimed
EP-0021824-A1 Process for production of acrylated urethanes and urethanes produced thereby UNION CARBIDE CORPORATION (US) 1981-01-07 EP claimed

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-20050070593-A1 Novel process for the preparation of trans-3-ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(4-methyl cyclohexyl) amino]carbonyl] amino]sulfonyl] phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide ALDH18A1, PRMT3, CPS1 ALDH1A1 1083/4885APLNR 1903/4885CYP3A4 14/4885

“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.