SCHEMBL301154

SCHEMBL301154

CC(C)CP(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 2/20 0.39
TAAR1 Q96RJ0 7/20 0.34
SLC6A2 P23975 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
MAOA P21397 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
CYP2A6 P11509 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
SLC18A2 Q05940 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALDH1A1 P00352 2/20 0.31
AOC3 Q16853 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
ALOX12 P18054 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
SCHEMBL10412405 0.98 TDP1 (0.38) TDP1CYP3A4TAAR1SLC6A2SIGMAR1
Bromide SCHEMBL1582867 0.95 TDP1 (0.36) TDP1CYP3A4TAAR1SLC6A2SIGMAR1
Hydrochloric Acid SCHEMBL1582787 0.95 TDP1 (0.36) TDP1CYP3A4TAAR1SLC6A2SIGMAR1
SCHEMBL5838621 0.90 TDP1 (0.39) TDP1CYP3A4TAAR1SLC6A2SIGMAR1
SCHEMBL4453154 0.85 TDP1 (0.39) TDP1CYP3A4TAAR1SLC6A2SIGMAR1
SCHEMBL13722624 0.81 MAOA (0.46) TAAR1SLC6A2SIGMAR1MAOASLC6A4
SCHEMBL3297250 0.81 LMNA (0.42) TDP1CYP3A4ESR1ESR2CYP2D6
SCHEMBL301136 0.80 CYP3A4 (0.39) TDP1CYP3A4TAAR1SLC6A2SIGMAR1
SCHEMBL6291622 0.79 TAAR1 (0.50) TAAR1MAOAALDH1A1AOC3
SCHEMBL613866 0.79 CYP3A4 (0.35) TDP1CYP3A4TAAR1SLC6A2SIGMAR1

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
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
CN-116078430-A Deep eutectic solvent and preparation method and application thereof 华东理工大学 2023-05-09 CN claimed
CN-111793343-B Polycarbonate composition and preparation method thereof 万华化学集团股份有限公司 2022-07-12 CN claimed
CN-112608402-B Styrene block copolymer and preparation method thereof 北京化工大学 2022-02-11 CN claimed
CN-112608402-A Styrene block copolymer and preparation method thereof 北京化工大学 2021-04-06 CN claimed
CN-111793343-A Polycarbonate composition and preparation method thereof 万华化学集团股份有限公司 2020-10-20 CN claimed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN claimed
CN-103153463-A Method for recovery and recycle of ruthenium homogeneous catalysts EASTMAN CHEM CO 2013-06-12 CN claimed
US-12018152-B2 Polybutadiene composition and method for producing same ENEOS MATERIALS CORPORATION (JP) 2024-06-25 US disclosed
EP-3896100-B1 POLYBUTADIENE COMPOSITION AND METHOD FOR PRODUCING SAME ENEOS MAT CORPORATION (JP) 2023-06-21 EP 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
CN-112500691-B High-impact-resistance, damp-heat-aging-resistant polycarbonate material and preparation method thereof 万华化学(四川)有限公司 2023-05-26 CN disclosed
CN-116078430-A Deep eutectic solvent and preparation method and application thereof 华东理工大学 2023-05-09 CN disclosed
EP-3810619-B1 TETRA-NUCLEAR NEUTRAL COPPER (I) COMPLEXES CLARIANT INT LTD (CH) 2023-04-26 EP disclosed
EP-1303563-A1 MIXTURES OF PHOSPHORUS-CONTAINING COMPOUNDS USED AS POLYMER STABILISERS Clariant Finance (BVI) Limited (VG) 2003-04-23 EP disclosed
WO-2002006390-A1 MIXTURES OF PHOSPHORUS-CONTAINING COMPOUNDS USED AS POLYMER STABILIZERS CLARIANT FINANCE (BVI) LIMITED (VG) 2002-01-24 WO 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
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