SCHEMBL301136

SCHEMBL301136

CC(C)CP(CC(C)C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 2/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TAAR1 Q96RJ0 6/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A3 Q01959 2/20 0.34
MAOA P21397 1/20 0.34
SLC6A4 P31645 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
CYP2A6 P11509 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
TRPA1 O75762 3/20 0.34
HPGD P15428 2/20 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
SCHEMBL9492218 0.87 CYP3A4 (0.33) CYP3A4TDP1ALDH1A1TAAR1SLC6A2
Pyridine SCHEMBL11210161 0.80 GAA (0.33) CYP3A4TDP1ALDH1A1ALOX12MAPK1
SCHEMBL301154 0.80 TDP1 (0.39) CYP3A4TDP1ALDH1A1ALOX15TSHR
SCHEMBL10805698 0.79 CYP3A4 (0.35) CYP3A4TDP1TAAR1SLC6A2SLC6A3
SCHEMBL6288582 0.79 TAAR1 (0.50) ALDH1A1TAAR1SLC6A3MAOATRPA1
SCHEMBL10412405 0.78 TDP1 (0.38) CYP3A4TDP1TAAR1SLC6A2SLC6A3
SCHEMBL12347960 0.78 TDP1 (0.38) CYP3A4TDP1ALDH1A1TAAR1SLC6A2
SCHEMBL8092418 0.78 ACHE (0.38) TDP1ALDH1A1TSHRSLC6A2SLC6A3
SCHEMBL7088869 0.77 TAAR1 (0.31) TDP1ALDH1A1TSHRHSD17B10TAAR1
SCHEMBL25199092 0.76 TDP1 (0.36) CYP3A4TDP1TAAR1SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
EP-4391765-A1 ORGANIC LIGHT EMITTING DIODE, DISPLAY DEVICE COMPRISING THE SAME AND COMPOUND Novaled GmbH (DE) 2024-06-26 EP disclosed
CN-111518145-B Cyano-bridged metal organic compound with intramolecular magnetic transformation and preparation method and application thereof 荆楚理工学院 2023-06-20 CN disclosed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US disclosed
EP-2990113-B1 METHOD FOR PRODUCING CATALYST FOR CYCLIC CARBONATE SYNTHESIS MARUZEN PETROCHEM CO LTD (JP) 2020-03-25 EP disclosed
EP-2990112-B1 METHOD FOR MANUFACTURING CATALYST FOR SYNTHESIZING CYCLIC CARBONATE MARUZEN PETROCHEM CO LTD (JP) 2020-03-25 EP disclosed
US-10029241-B2 Method for producing catalyst for cyclic carbonate synthesis MARUZEN PETROCHEMICAL CO., LTD. (JP) 2018-07-24 US disclosed
US-10011621-B2 Method for producing silica gel-immobolized phosphonium salt catalysts MARUZEN PETROCHEMICAL CO., LTD. (JP) 2018-07-03 US disclosed
CN-105163853-B The manufacturing method of cyclic carbonate catalyst for synthesizing 丸善石油化学株式会社 2018-06-12 CN disclosed
US-9834536-B2 Method for producing catalyst for cyclic carbonate synthesis NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2017-12-05 US disclosed
CN-1064967-C Preparation of arylalkyl phosphines, phosphine oxides or phosphine sulfides CYTEC CANADA INC (CA) 2001-04-25 CN disclosed
EP-0732336-B1 Process for the preparation of arylalkyl phosphines, arylalkyl phosphine oxides or arylalkyl phosphine sulfides CYTEC CANADA INC (CA) 2000-12-20 EP disclosed
CN-1139112-A Preparation of arylalkyl phosphines, phosphine oxides or phosphine sulfides CYTEC CANADA INC (CA) 1997-01-01 CN disclosed
EP-0732336-A1 Process for the preparation of arylalkyl phosphines, arylalkyl phosphine oxides or arylalkyl phosphine sulfides Cytec Canada Inc. (CA) 1996-09-18 EP disclosed
US-5550295-A Preparation of arylalkyl phosphines, phosphine oxides or phosphine sulfides CYTEC TECHNOLOGY CORP. (US) 1996-08-27 US disclosed
US-4668823-A ARYLDICHLOROPHOSPHINE, TWO GRIGNARDS UNION CARBIDE CORPORATION (US) 1987-05-26 US disclosed
EP-0003897-B1 PHOSPHINEGOLD(I)SALTS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM SMITHKLINE BECKMAN CORPORATION (US) 1983-05-25 EP disclosed
US-4257973-A USING ORGANOPHOSPHORUS-PALLADIUM HALIDE COORDINATION CATALYST E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-24 US disclosed
EP-0003897-A1 Phosphinegold(I)salts, process for their preparation and compositions containing them SMITHKLINE BECKMAN CORPORATION (US) 1979-09-05 EP disclosed
US-4096250-A ANTI-ARTHRITIC SMITHKLINE CORPORATION (US) 1978-06-20 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-10029241-B2 Method for producing catalyst for cyclic carbonate synthesis CYCS, CA7, CA9 CYP3A4 349/4885TDP1 4293/4885ALDH1A1 3770/4885
US-10011621-B2 Method for producing silica gel-immobolized phosphonium salt catalysts SIK2, SIK3, SIK1 CYP3A4 2971/4885TDP1 3328/4885ALDH1A1 4167/4885

“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.