SCHEMBL28514575

SCHEMBL28514575

CC1CCC(C)(N2CCCCC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACHE P22303 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
CCR5 P51681 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
Perflunafene SCHEMBL28522734 0.87
SCHEMBL10190116 0.86 PHGDH (0.32) ALDH1A1ACHEOPRM1OPRL1
SCHEMBL11212318 0.80 CCR5 (0.36) OPRM1OPRL1CCR5
SCHEMBL10203454 0.78 MEN1 (0.32)
SCHEMBL10203447 0.78 MEN1 (0.32)
SCHEMBL10190103 0.78 MEN1 (0.32)
SCHEMBL10862800 0.78 LPAR1 (0.33)
SCHEMBL23268045 0.78 PHGDH (0.33) ALDH1A1ACHEOPRM1OPRL1CCR5
SCHEMBL6496554 0.78 GRIN1 (0.37) OPRM1OPRL1CCR5
SCHEMBL633802 0.78 GRIN1 (0.37) OPRM1OPRL1CCR5

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111214459-B Perfluorocarbon albumin nanoparticles and application thereof in preparation of tumor treatment drugs 南京大学 2022-09-23 CN claimed
CN-108114273-B Perfluorocarbon albumin nanoparticles and preparation method and application thereof 南京大学 2020-12-22 CN claimed
CN-111214459-A Perfluorocarbon albumin nanoparticles and application thereof in preparation of tumor treatment drugs 南京大学 2020-06-02 CN claimed
CN-111214459-B Perfluorocarbon albumin nanoparticles and application thereof in preparation of tumor treatment drugs 南京大学 2022-09-23 CN disclosed
CN-108114273-B Perfluorocarbon albumin nanoparticles and preparation method and application thereof 南京大学 2020-12-22 CN disclosed
CN-111214459-A Perfluorocarbon albumin nanoparticles and application thereof in preparation of tumor treatment drugs 南京大学 2020-06-02 CN disclosed