SCHEMBL18723549

SCHEMBL18723549

CC1C(CCn2cncn2)CC1CN1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.36
POLB P06746 1/20 0.33
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL8216729 1.00 EGLN3 (0.36) EGLN3POLBALDH1A1MAPTSMN1; SMN2
SCHEMBL8221078 0.78 L3MBTL1 (0.34) POLBALDH1A1KMT2A
SCHEMBL3315410 0.76 EGLN3 (0.31) EGLN3POLB
SCHEMBL23201120 0.67 CYP19A1 (0.38) EGLN3ALDH1A1
SCHEMBL18723738 0.66 CYP1A2 (0.42) POLBALDH1A1MAPT
SCHEMBL3377520 0.66 ADORA3 (0.32)
SCHEMBL8218068 0.66 BRD4 (0.35) KMT2A
SCHEMBL1430632 0.65 CYP19A1 (0.38) EGLN3ALDH1A1MAPTSMN1; SMN2
SCHEMBL18723481 0.64 PLK1 (0.35)
SCHEMBL3318958 0.64 ADORA3 (0.32) EGLN3

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-2066648-B1 SUBSTITUTED DIMETHYLCYCLOBUTYL COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS ESTEVE LABOR DR (ES) 2017-04-12 EP disclosed