SCHEMBL9913795

SCHEMBL9913795

C[C@H]1CC[C@H](C)P1c1ccccc1P1[C@@H](C)CC[C@@H]1C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL19968395 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL12639417 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL12661273 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL2913969 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL14092707 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL12084063 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL14045335 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL29516775 1.00 MEN1 (0.33) MEN1PKMTSHRKMT2A
SCHEMBL21150607 0.93 ACHE (0.32) MEN1PKMTSHRKMT2A
SCHEMBL21150260 0.93 MEN1 (0.31) MEN1PKMTSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220176363-A1 PROCESS FOR OLIGOMERIZATION DOW GLOBAL TECHNOLOGIES LLC (US) 2022-06-09 US disclosed
US-20220048917-A1 HIGHLY EFFICIENT PROCESS FOR THE PREPARATION OF SITAGLIPTIN VIA RHODIUM CATALYZED ASYMMETRIC HYDROGENATION COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2022-02-17 US disclosed
CN-113896607-A Olefin oligomerization process using catalyst comprising chromium complex with phosphacycle-containing ligand 陶氏环球技术有限责任公司 2022-01-07 CN disclosed
CN-107592863-B Chromium complexes with ligands containing phosphacycles and olefin oligomerization catalysts therefrom 陶氏环球技术有限责任公司 2021-09-10 CN disclosed
CN-107567355-B Phosphacycle-containing ligands for chromium complexes and olefin oligomerization catalysts therefrom 陶氏环球技术有限责任公司 2021-07-23 CN disclosed
US-20210129125-A1 PROCESS FOR OLIGOMERIZATION DOW GLOBAL TECHNOLOGIES LLC (US) 2021-05-06 US disclosed
US-10981156-B2 Chromium complex and catalyst therefrom DOW GLOBAL TECHNOLOGIES LLC (US) 2021-04-20 US disclosed
US-10919031-B2 Process for oligomerization DOW GLOBAL TECHNOLOGIES LLC (US) 2021-02-16 US disclosed
US-20200338542-A1 PROCESS FOR OLIGOMERIZATION DOW GLOBAL TECHNOLOGIES LLC (US) 2020-10-29 US disclosed
WO-2020194337-A2 A PROCESS FOR THE ASYMMETRIC SYNTHESIS OF SITAGLIPTIN INTERMEDIATE COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2020-10-01 WO disclosed
EP-1849792-B1 Biphosphine ruthenium complexes with chiral diamine ligands as catalysts JOHNSON MATTHEY PLC (GB) 2008-12-10 EP disclosed
WO-2008119161-A1 METHODS OF PREPARING SECONDARY CARBINAMINE COMPOUNDS WITH BORONIC ACIDS KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2008-10-09 WO disclosed
WO-2008119162-A1 METHODS OF PREPARING PRIMARY, SECONDARY AND TERTIARY CARBINAMINE COMPOUNDS IN THE PRESENCE OF AMMONIA KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2008-10-09 WO disclosed
US-20080154047-A1 Process For the Preparation of Enantiomerically Pure1-Substitued-3-Aminoalcohols LONZA AG (CH) 2008-06-26 US disclosed
US-20080039639-A1 Chromane and chromene derivatives and uses thereof WYETH (US) 2008-02-14 US disclosed
US-20080039639-A1 Chromane and chromene derivatives and uses thereof WYETH (US) 2008-02-14 US disclosed
EP-1849792-A1 Biphosphine ruthenium complexes with chiral diamine ligands as catalysts Johnson Matthey PLC (GB) 2007-10-31 EP disclosed
US-7235510-B2 Catalysts JOHNSON MATTHEY PLC (GB) 2007-06-26 US disclosed
US-20070088022-A1 Tetrahydroquinolines, synthesis thereof, and intermediates thereto WYETH (US) 2007-04-19 US disclosed
US-20070066850-A1 Catalysts JOHNSON MATTHEY PLC (GB) 2007-03-22 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 (10 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-20070088022-A1 Tetrahydroquinolines, synthesis thereof, and intermediates thereto HTR2C, HTR3B, HTR2A MEN1 1319/4885PKM 3335/4885TSHR 642/4885
US-20210129125-A1 PROCESS FOR OLIGOMERIZATION OXER1, NOD1, LIG1 MEN1 1539/4885PKM 2978/4885TSHR 4279/4885
US-20200338542-A1 PROCESS FOR OLIGOMERIZATION OXER1, NOD1, LIG1 MEN1 1539/4885PKM 2978/4885TSHR 4279/4885
US-20070066850-A1 Catalysts HRH3, PRMT1, HRH4 MEN1 694/4885PKM 1636/4885TSHR 957/4885
US-20220048917-A1 HIGHLY EFFICIENT PROCESS FOR THE PREPARATION OF SITAGLIPTIN VIA RHODIUM CATALYZED ASYMMETRIC HYDROGENATION DPP4, DPP7, DPP9 MEN1 556/4885PKM 1269/4885TSHR 835/4885
US-10919031-B2 Process for oligomerization OXER1, NOD1, LIG1 MEN1 1539/4885PKM 2978/4885TSHR 4279/4885
US-20080039639-A1 Chromane and chromene derivatives and uses thereof HTR1A, CHRM1, HTR2C MEN1 1074/4885PKM 2411/4885TSHR 68/4885
US-10981156-B2 Chromium complex and catalyst therefrom OXER1, LIG1, PICALM MEN1 2246/4885PKM 707/4885TSHR 4123/4885
US-20080154047-A1 Process For the Preparation of Enantiomerically Pure1-Substitued-3-Aminoalcohols ADH1A, ADH1C, ALDH7A1 MEN1 1729/4885PKM 104/4885TSHR 3042/4885
US-20220176363-A1 PROCESS FOR OLIGOMERIZATION OXER1, NOD1, LIG1 MEN1 1539/4885PKM 2978/4885TSHR 4279/4885

“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.