Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 2/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8443134 | 0.76 | KMT2A (0.51) | PKMSMN1; SMN2CHRM1LMNAPAX8 | |
| SCHEMBL5986343 | 0.71 | POLB (0.55) | CNR2POLBCES2CES1AKR1B1 | |
| SCHEMBL5431716 | 0.71 | TSHR (0.52) | CNR2POLBCES2CES1AKR1B1 | |
| SCHEMBL13074658 | 0.71 | TSHR (0.52) | CNR2POLBCES2CES1AKR1B1 | |
| SCHEMBL11613937 | 0.70 | POLB (0.49) | CNR2POLBCES2CES1AKR1B1 | |
| SCHEMBL7635436 | 0.70 | LMNA (0.58) | CNR2CES2CES1AKR1B1LMNA | |
| SCHEMBL28577864 | 0.70 | CES1 (0.54) | CNR2CES2CES1AKR1B1TSHR | |
| SCHEMBL8419057 | 0.70 | SOAT2 (0.59) | LMNAPAX8EPHX1 | |
| SCHEMBL9000782 | 0.70 | SOAT2 (0.59) | LMNAPAX8EPHX1 | |
| SCHEMBL11536485 | 0.69 | SOAT2 (0.46) | POLBCES2CES1LMNAPAX8 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4119788-A | ODORS, FLAVORS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1978-10-10 | — | — | US | disclosed |
| US-4107197-A | KETONE REACTED WITH SULFURYL CHLORIDE, ALPHA-CHLORO KETONE REACTED WITH ALKALI METAL COMPOUND | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1978-08-15 | — | — | US | disclosed |
| US-4097532-A | ENHANCING FLAVOR AND AROMA | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1978-06-27 | — | — | US | disclosed |
| US-4088697-A | 3-PROPYLTHIO-4-HEPTANOL; FOODSTUFF FLAVORS OR ODORANTS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1978-05-09 | — | — | US | disclosed |
| US-4083862-A | α-Oxy(oxo) sulfides and ethers | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1978-04-11 | — | — | US | disclosed |
| US-4061795-A | Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-12-06 | — | — | US | disclosed |
| US-4061796-A | Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-12-06 | — | — | US | disclosed |
| US-4055691-A | Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-10-25 | — | — | US | disclosed |
| US-4053655-A | Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-10-11 | — | — | US | disclosed |
| US-4053654-A | Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-10-11 | — | — | US | disclosed |
| US-4045491-A | PERFUMES | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-08-30 | — | — | US | disclosed |
| US-4044164-A | BERRY, CEREAL, NUT, BROCCOLI, ONION, CITRUS, JASMIN, MILK CARAMEL, GRAPE | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1977-08-23 | — | — | US | disclosed |