Cyclohexane

Cyclohexane

SCHEMBL6560747

C1CCCCC1.CC1(C)CCCCC1(C(=O)O)C(=O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.42
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TSHR P16473 2/20 0.33
NFKB1 P19838 1/20 0.33
LMNA P02545 2/20 0.31
AKR1C1 Q04828 1/20 0.31
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL783114 0.97 FFAR3 (0.43) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR
SCHEMBL11800203 0.92 FFAR3 (0.43) FFAR3CYP2C19SMN1; SMN2TSHRNFKB1
SCHEMBL7745103 0.82 PEPD (0.39) ALDH1A1SMN1; SMN2LMNA
SCHEMBL18438824 0.81 FFAR3 (0.48) FFAR3CYP2C19SMN1; SMN2TSHRNFKB1
SCHEMBL19326635 0.81 CYP2C19 (0.46) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR
SCHEMBL16819028 0.81 CYP2C19 (0.46) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR
SCHEMBL19326636 0.81 CYP2C19 (0.46) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR
SCHEMBL19326647 0.81 CYP2C19 (0.46) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR
SCHEMBL10749636 0.81 CYP2C19 (0.46) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR
SCHEMBL19326637 0.81 CYP2C19 (0.46) FFAR3CYP2C19ALDH1A1SMN1; SMN2TSHR

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1031340-B1 Means to maintain configuration of flexible medical container BRACCO INT BV (NL) 2004-05-06 EP claimed
US-6179822-B1 Single use universal access device/medical container assembly BRACCO RESEARCH USA 2001-01-30 US claimed
US-4978579-A Sterile surfaces for flexible containers BAXTER INTERNATIONAL INC. (US) 1990-12-18 US claimed
EP-0320647-A2 Polycarbonate composition with low heat distortion GENERAL ELECTRIC COMPANY (US) 1989-06-21 EP claimed
EP-0320651-A2 Thermoplastic polycarbonate-polyester blends GENERAL ELECTRIC COMPANY (US) 1989-06-21 EP claimed
EP-0320648-A2 Flame retardant-low heat distortion polycarbonates with low gloss GENERAL ELECTRIC COMPANY (US) 1989-06-21 EP claimed
JP-1230665-A None JP disclosed
CN-113785157-B Lighting device LG伊诺特有限公司 2024-06-14 CN disclosed
CN-117203063-A Method for locally coloring plastic parts using solid dyes in a color carrier layer 科思创德国股份有限公司 2023-12-08 CN disclosed
CN-113226757-B Plastic film in the form of a layer structure with a high Vicat softening temperature 科思创知识产权两合公司 2023-10-24 CN disclosed
CN-116348308-A Layer structure with engraved pattern as visible security element 科思创德国股份有限公司 2023-06-27 CN disclosed
CN-114177134-A Intravenous infusion dosage forms of pemetrexed 太阳制药工业公司 2022-03-15 CN disclosed
CN-113543769-A Infusion bag for midazolam for intravenous use 太阳医药工业有限公司 2021-10-22 CN disclosed
EP-0899302-B1 Polycarbonate compositions comprising polyester resins and ultraviolet light absorbers GEN ELECTRIC (US) 2003-06-11 EP disclosed
US-5769839-A PLASTIC BAG FREE OF BLOOD EXTRACTABLE PLASTICIZERS; HYPTONIC CELL PRESERVATION SOLUTION PALL CORPORATION (US) 1998-06-23 US disclosed
EP-0793414-A2 LONG-TERM BLOOD COMPONENT STORAGE SYSTEM AND METHOD Pall Corporation (US) 1997-09-10 EP disclosed
EP-0594842-B1 COEXTRUDED MEDICAL GRADE PORT TUBING BAXTER INT (US) 1997-07-16 EP disclosed
WO-1996014741-A2 LONG-TERM BLOOD COMPONENT STORAGE SYSTEM AND METHOD PALL CORPORATION (US) 1996-05-23 WO disclosed
US-4978579-A Sterile surfaces for flexible containers BAXTER INTERNATIONAL INC. (US) 1990-12-18 US disclosed
JP-H01230665-A FLAME RETARDANT HEAT DISTORTION POLYCARBONATE WITH LOW GLOSS GENERAL ELECTRIC CO <GE> 1989-09-14 JP disclosed