SCHEMBL25639671

SCHEMBL25639671

C=C(C)N1CCN(C2CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.39
MGLL Q99685 1/20 0.39
HRH3 Q9Y5N1 5/20 0.38
KCNH2 Q12809 3/20 0.38
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL3 Q96JM7 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ALOX15 P16050 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL18177695 0.87 OPRL1 (0.39)
SCHEMBL18177696 0.87 OPRL1 (0.39)
SCHEMBL18667948 0.86 HRH3 (0.46) HRH3
SCHEMBL21568056 0.86 HRH3 (0.38) PHGDHMGLLHRH3KCNH2MEN1
SCHEMBL19288816 0.83 L3MBTL3 (0.44) HRH3ALDH1A1KDM4EL3MBTL3L3MBTL1
SCHEMBL19313040 0.82 KMT2A (0.45) PHGDHMGLLKMT2A
SCHEMBL7863270 0.79
SCHEMBL23367198 0.77 TP53 (0.38) PHGDHMGLLHRH3MEN1KMT2A
SCHEMBL15508283 0.76 CYP1A2 (0.52) HRH3KCNH2POLBHSD17B10ALDH1A1
SCHEMBL19128943 0.76 HRH3 (0.33) HRH3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4198024-A1 PYRAZOLE MAGL INHIBITORS H. Lundbeck A/S (DK) 2023-06-21 EP disclosed