Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Cyclohexane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | MMP2 | P08253 | 5/20 | 0.40 |
| ▸ | FDPS | P14324 | 4/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL27568448 | 1.00 | — | — | |
| Phosphoric Acid SCHEMBL28199427 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cyclopentane SCHEMBL5865696 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cyclohexane SCHEMBL269925 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cyclohexane SCHEMBL521319 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cyclohexane SCHEMBL25174142 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Phosphoric Acid SCHEMBL28406252 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cyclopentane SCHEMBL6835511 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cycloheptane SCHEMBL7041097 | 1.00 | TSHR (0.42) | TSHRCYP2C19CA2MMP2FDPS | |
| Cyclohexane SCHEMBL6654263 | 0.95 | TSHR (0.40) | TSHRCYP2C19CA2MMP2FDPS |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6797678-B2 | OBTAINED BY HEATING AN ACIDIC PHOSPHATE ESTER AND/OR A PHOSPHITE ESTER AND AN IMIDE-BASED DISPERSANT (SUCH AS POLYBUTENYL SUCCINIMIDE) CONTAINING BORON; WEAR RESISTANCE, SCORING RESISTANCE AND PROLONGS SURFACE FATIGUE LIFE | IDEMITSU KOSAN CO., LTD. (JP) | 2004-09-28 | — | — | US | disclosed |
| US-20020165102-A1 | Lubricating oil composition for cellulose base wet friction material | IDEMITSU KOSAN CO., LTD. (JP) | 2002-11-07 | — | — | US | disclosed |
| US-20020055441-A1 | Lubricant additive | IDEMITSU KOSAN CO., LTD. (JP) | 2002-05-09 | — | — | US | disclosed |
| US-6352962-B1 | ADDITIVE FOR TRACTION DRIVE FLUID OBTAINED BY HEATING AT LEAST ONE ESTER SELECTED FROM ACIDIC PHOSPHATE ESTER AND PHOSPHITE ESTER AND SUCCINIMIDE DISPERSANT CONTAINING BORON AT TEMPERATURE OF 120 TO 150 DEGREES C. FOR 5 HOURS OR MORE | IDEMITSU KOSAN CO., LTD. (JP) | 2002-03-05 | — | — | US | disclosed |
| US-6303546-B1 | CONTAINING PHOSPHATE ESTER, BORON-CONTAINING IMIDE BASE DISPERSANT AND BORON-FREE IMIDE BASE DISPERSANT | IDEMITSU KOSAN CO., LTD. (JP) | 2001-10-16 | — | — | US | disclosed |
| EP-1142983-A1 | Lubricant additive | IDEMITSU KOSAN COMPANY LIMITED (JP) | 2001-10-10 | — | — | EP | disclosed |
| EP-1057884-A1 | Traction drive fluid | IDEMITSU KOSAN COMPANY LIMITED (JP) | 2000-12-06 | — | — | EP | disclosed |
| EP-1057882-A1 | Lubricating oil composition for cellulose base wet friction material | IDEMITSU KOSAN CO., LTD. (JP) | 2000-12-06 | — | — | EP | disclosed |