SCHEMBL1731885

SCHEMBL1731885

CCOC(=O)CNCc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 5/20 0.49
PPID Q08752 1/20 0.49
MEN1 O00255 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ATM Q13315 1/20 0.48
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CDC25B P30305 2/20 0.46
CDC25A P30304 1/20 0.46
CDC25C P30307 1/20 0.46
MAPT P10636 1/20 0.46
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 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
SCHEMBL4679636 0.87 ATM (0.55) ALDH1A1KMT2AMEN1L3MBTL1ATM
SCHEMBL16839711 0.86 TOP2A (0.52) ALDH1A1HPGDKMT2AMEN1ATM
Hydrochloric Acid SCHEMBL8439823 0.85 ATM (0.54) ALDH1A1KMT2AMEN1L3MBTL1ATM
SCHEMBL2053656 0.85 PPID (0.67) ALDH1A1HPGDKMT2APPIDMEN1
SCHEMBL3097866 0.81 GAA (0.45) ALDH1A1HPGDKMT2APPIDMEN1
SCHEMBL12749491 0.81 MAPK8 (0.45) ALDH1A1HPGDKMT2APPIDMEN1
SCHEMBL6240662 0.81 TSHR (0.55) PPIDKDM4EMAPTCYP4F2CYP4A11
SCHEMBL845701 0.80 KMT2A (0.62) ALDH1A1HPGDKMT2AL3MBTL1ATM
SCHEMBL29729685 0.80 KMT2A (0.62) ALDH1A1HPGDKMT2AL3MBTL1ATM
SCHEMBL6753141 0.79 ALDH1A1 (0.60) ALDH1A1HPGDKMT2AMEN1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112759533-A Method for generating nitrile by catalyzing amine oxidation through nonmetal mesoporous nitrogen-doped carbon material 中国科学院大连化学物理研究所 2021-05-07 CN claimed
WO-2010112946-A1 ADAMANTANE BISUREA DERIVATIVES, METHOD OF PREPARATION AND APPLICATION IN ANION SENSING RUDJER BOSKOVIC INSTITUTE (HR) 2010-10-07 WO claimed
CN-109963886-B Phosphoguanidine group IV metal olefin polymerization catalyst 陶氏环球技术有限责任公司 2023-01-06 CN disclosed
US-11066495-B2 Phosphaguanidine group IV metal olefin polymerization catalysts DOW GLOBAL TECHNOLOGY LLC (US) 2021-07-20 US disclosed
CN-112759533-A Method for generating nitrile by catalyzing amine oxidation through nonmetal mesoporous nitrogen-doped carbon material 中国科学院大连化学物理研究所 2021-05-07 CN disclosed
EP-3519470-B1 PHOSPHAGUANIDINE GROUP IV METAL OLEFIN POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2020-10-21 EP disclosed
US-20200031960-A1 PHOSPHAGUANIDINE GROUP IV METAL OLEFIN POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2020-01-30 US disclosed
EP-3519470-A1 PHOSPHAGUANIDINE GROUP IV METAL OLEFIN POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-08-07 EP disclosed
WO-2018064493-A1 PHOSPHAGUANIDINE GROUP IV METAL OLEFIN POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2018-04-05 WO disclosed
EP-1961733-B1 METHOD FOR SELECTIVELY PRODUCING PRIMARY AMINE COMPOUND SUMITOMO CHEMICAL CO (JP) 2014-08-20 EP disclosed
US-8269044-B2 Method for selectively producing primary amine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-18 US disclosed
US-5318988-A Treating psychoses BAYER AKTIENGESELLSCHAFT (DE) 1994-06-07 US disclosed
US-5298220-A Forming a coating of a solution containing anioic and cationic dyes and water insoluble organonitrogen compound, drying SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-03-29 US disclosed
US-5196164-A During addition polymerization, wall coating of anionic dye and cationic dye and organonitrogen compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1993-03-23 US disclosed
EP-0355575-A2 Method of preventing polymer scale formation Shin-Etsu Chemical Co., Ltd. (JP) 1990-02-28 EP disclosed
US-4680291-A ANTIMYCOTIC AGENTS SANDOZ LTD. (CH) 1987-07-14 US disclosed
EP-0000896-B1 PROPENYL AMINES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANDOZ AG (CH) 1982-10-13 EP disclosed
US-4282251-A FUNGICIDES SANDOZ LTD. (CH) 1981-08-04 US disclosed
EP-0000896-A2 Propenyl amines, processes for their production and pharmaceutical compositions containing them SANDOZ AG (CH) 1979-03-07 EP disclosed
US-4094831-A TERPOLYMER OF A DIENE, OLEFIN AND A VINYL OR ACRYLIC EPOXY COMPOUND THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-06-13 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 (2 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-11066495-B2 Phosphaguanidine group IV metal olefin polymerization catalysts POLG, ODC1, RNGTT ALDH1A1 1383/4885HPGD 487/4885KMT2A 3113/4885
US-20200031960-A1 PHOSPHAGUANIDINE GROUP IV METAL OLEFIN POLYMERIZATION CATALYSTS POLG, ODC1, RNGTT ALDH1A1 1383/4885HPGD 487/4885KMT2A 3113/4885

“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.