SCHEMBL22289581

SCHEMBL22289581

CCCCCNC(=O)N1CCC2(CCc3ccccc3O2)CC1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 2/20 0.61
▸ NAMPT P43490 4/20 0.56
▸ EPHX2 P34913 4/20 0.54
▸ EPHX1 P07099 1/20 0.49
▸ DRD2 P14416 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ SIGMAR1 Q99720 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ CNR2 P34972 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ PKM P14618 1/20 0.43
▸ ADRA1D P25100 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ ADRA1B P35368 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL1912695 0.87 TRPM8 (0.68) TRPM8EPHX2EPHX1DRD2HTR2A
SCHEMBL1912694 0.81 TRPM8 (0.73) TRPM8EPHX2EPHX1DRD2HTR2A
SCHEMBL1912702 0.78 TRPM8 (0.61) TRPM8EPHX2EPHX1DRD2HTR2A
SCHEMBL20616667 0.76 TRPM8 (0.59) TRPM8EPHX2EPHX1DRD2HTR2A
SCHEMBL29964837 0.75 TRPM8 (0.71) TRPM8EPHX2EPHX1DRD2HTR2A
SCHEMBL8576957 0.74 DRD2 (0.67) TRPM8DRD2HTR2ASIGMAR1ADRA1D
SCHEMBL30724364 0.74 TRPM8 (0.66) TRPM8EPHX2EPHX1DRD2HTR2A
SCHEMBL3703772 0.73 NAMPT (1.00) NAMPT
SCHEMBL3708561 0.73 NAMPT (1.00) NAMPT
SCHEMBL3704595 0.72 NAMPT (0.82) NAMPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113677334-B Transient receptor potential MELASTATIN 8 (TRPM 8) antagonists and related methods 马歇尔大学科研协会 2024-04-09 — — CN disclosed
EP-3917510-A1 TRANSIENT RECEPTOR POTENTIAL MELASTATIN 8 (TRPM8) ANTAGONISTS AND RELATED METHODS Marshall University Research Corporation (US) 2021-12-08 — — EP disclosed
CN-113677334-A Transient receptor potential MELASTATIN 8(TRPM8) antagonists and related methods 马歇尔大学科研协会 2021-11-19 — — CN disclosed
WO-2020160464-A1 TRANSIENT RECEPTOR POTENTIAL MELASTATIN 8 (TRPM8) ANTAGONISTS AND RELATED METHODS MARSHALL UNIVERSITY RESEARCH CORPORATION (US) 2020-08-06 — — WO disclosed
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