Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.53 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | TGM2 | P21980 | 2/20 | 0.46 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.46 |
| ▸ | F13A1 | P00488 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1806027 | 0.81 | ALDH5A1 (0.59) | LMNACA1CA2NPC1HPGD | |
| SCHEMBL8975154 | 0.81 | HDAC1 (0.61) | GSK3BHDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL11738823 | 0.80 | GSK3B (0.53) | GSK3BHDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL3415923 | 0.79 | GSK3B (0.57) | GSK3BCES2CES1ATMLMNA | |
| SCHEMBL3630757 | 0.79 | TSHR (0.42) | KMT2ALMNASMN1; SMN2NPC1HPGD | |
| SCHEMBL14388863 | 0.79 | GSK3B (0.55) | GSK3BHDAC1HDAC8HDAC3HDAC4 | |
| SCHEMBL27800538 | 0.79 | KDM4E (0.47) | KMT2ACA1CA2CYP2C19 | |
| SCHEMBL8519584 | 0.79 | NPC1 (0.55) | CES2CES1KMT2ATGM2SMN1; SMN2 | |
| SCHEMBL6975977 | 0.79 | GSK3B (0.57) | GSK3BHDAC1HDAC8HDAC3HDAC4 | |
| Water SCHEMBL27991728 | 0.79 | HDAC1 (0.59) | GSK3BHDAC1HDAC8HDAC3HDAC4 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1468994-B1 | Process for preparing cyclic amine substituted phenyl-alkyl-ketones | BASF SE (DE) | 2010-11-24 | — | — | EP | claimed |
| CN-1072662-C | Cyclic amine-substituted phenylalkyl ketones and process for their preparation | CIBA SC HOLDING AG (CH) | 2001-10-10 | — | — | CN | claimed |
| US-5977357-A | Phenyl alkyl ketone substituted by cyclic amine and a process for the preparation thereof | CIBA SPECIALTY CHEMICAL CORPORATION (US) | 1999-11-02 | — | — | US | claimed |
| US-5795985-A | Phenyl alkyl ketone substituted by cyclic amine and a process for the preparation thereof | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-08-18 | — | — | US | claimed |
| CN-1166487-A | Cyclic amine-substituted phenylalkyl ketones and process for their preparation | CIBA GEIGY AG (CH) | 1997-12-03 | — | — | CN | claimed |
| JP-6321844-A | — | — | None | — | — | JP | disclosed |
| CN-1168700-C | Cyclic amine substd. phenylalkanone and preparing method thereof | ϣ�����⻯ѧ�عɹ�˾ | 2004-09-29 | — | — | CN | disclosed |
| CN-1072662-C | Cyclic amine-substituted phenylalkyl ketones and process for their preparation | CIBA SC HOLDING AG (CH) | 2001-10-10 | — | — | CN | disclosed |
| CN-1309116-A | Cyclic amine substd. phenylalkanone and preparing method thereof | CIBA SC HOLDING AG (CH) | 2001-08-22 | — | — | CN | disclosed |
| US-6191182-B1 | SUBJECTING P-HALOPHENYL ALKYL KETONE TO AMINOLYSIS WITH CYCLIC SECONDARY AMINE TO FORM CYCLIC AMINE-SUBSTITUTED PHENYL ALKYL KETONE; HALOGINATION AND REACTING WITH AMINE COMPOUND; STEVENS REARRANGEMENT UNDER BASIC CONDITION | CIBA SPECIALTY CHEMCIALS CORPORATION | 2001-02-20 | — | — | US | disclosed |
| US-5977357-A | Phenyl alkyl ketone substituted by cyclic amine and a process for the preparation thereof | CIBA SPECIALTY CHEMICAL CORPORATION (US) | 1999-11-02 | — | — | US | disclosed |
| US-5922898-A | Process for preparing biaryl compounds | CATALYTICA PHARMACEUTICALS, INC. (US) | 1999-07-13 | — | — | US | disclosed |
| US-5795985-A | Phenyl alkyl ketone substituted by cyclic amine and a process for the preparation thereof | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1998-08-18 | — | — | US | disclosed |
| CN-1166487-A | Cyclic amine-substituted phenylalkyl ketones and process for their preparation | CIBA GEIGY AG (CH) | 1997-12-03 | — | — | CN | disclosed |
| JP-H06321844-A | TOLAN DERIVATIVE COMPOUND, LIQUID CRYSTAL MATERIAL AND LIQUID CRYSTAL ELEMENT CONTAINING THE SAME | JAPAN CARLIT CO LTD:THE | 1994-11-22 | — | — | JP | disclosed |