Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.66 |
| ▸ | CES1 | P23141 | 1/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.54 |
| ▸ | FEN1 | P39748 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | TNKS | O95271 | 1/20 | 0.51 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.51 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.51 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.51 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.51 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL28109552 | 0.85 | AKR1C3 (0.64) | AKR1C3HDAC8ERCC5FEN1TNKS | |
| SCHEMBL7248002 | 0.84 | CES1 (0.67) | CES1ERCC5FEN1PARP10 | |
| SCHEMBL26054651 | 0.83 | AKR1C3 (0.66) | AKR1C3HDAC8ERCC5FEN1TNKS | |
| SCHEMBL6682185 | 0.81 | AKR1C3 (0.64) | AKR1C3HDAC8ERCC5FEN1TNKS | |
| SCHEMBL2500212 | 0.81 | CES1 (0.65) | CES1ACHENPC1RAB9AKDM4E | |
| SCHEMBL30214744 | 0.81 | CES1 (0.65) | CES1ACHENPC1RAB9AKDM4E | |
| SCHEMBL9315114 | 0.80 | AKR1C3 (0.72) | AKR1C3HDAC8ERCC5FEN1TNKS | |
| SCHEMBL29890076 | 0.80 | NR4A2 (0.70) | — | |
| SCHEMBL26933189 | 0.80 | NR4A2 (0.70) | — | |
| M-Phenoxybenzoic Acid For Cis-Isomer SCHEMBL30445868 | 0.80 | AKR1C3 (1.00) | AKR1C3HDAC8ERCC5FEN1TNKS |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0623103-B1 | PROCESS FOR PRODUCING TRIFLUOROMETHYL KETONES | HOECHST SCHERING AGREVO GMBH (DE) | 1997-09-03 | — | — | EP | disclosed |
| WO-1997009672-A1 | TRANSPARENT SUPPORT OF PROTOCOL AND DATA COMPRESSION FEATURES FOR DATA COMMUNICATION | U.S. ROBOTICS CORPORATION (US) | 1997-03-13 | — | — | WO | disclosed |
| US-5608062-A | Process for preparing trifluoromethyl ketones | HOECHST SCHERING AGREVO GMBH (DE) | 1997-03-04 | — | — | US | disclosed |
| EP-0623103-A1 | PROCESS FOR PRODUCING TRIFLUOROMETHYL KETONES. | HOECHST SCHERING AGREVO GMBH (DE) | 1994-11-09 | — | — | EP | disclosed |
| WO-1993014054-A1 | PROCESS FOR PRODUCING TRIFLUOROMETHYL KETONES | HOECHST SCHERING AGREVO GMBH (DE) | 1993-07-22 | — | — | WO | disclosed |
| US-4833163-A | INSECTICIDES, NEMATOCIDES, MITICIDES | ROUSSEL UCLAF (FR) | 1989-05-23 | — | — | US | disclosed |
| US-4411912-A | Insecticidal isovaleric acid esters | ZOECON CORPORATION (US) | 1983-10-25 | — | — | US | disclosed |
| US-4243819-A | Substituted amino acids | ZOECON CORPORATION (US) | 1981-01-06 | — | — | US | disclosed |
| US-4162366-A | INSECTICIDES | FMC CORPORATION (US) | 1979-07-24 | — | — | US | disclosed |
| US-4152455-A | PYRETHROID CARBOXYLIC ACID MOIETY | FMC CORPORATION (US) | 1979-05-01 | — | — | US | disclosed |