SCHEMBL9237227

SCHEMBL9237227

CCCCCn1cc(N2CCCCC2)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.49
ICMT O60725 1/20 0.48
CNR2 P34972 11/20 0.47
CNR1 P21554 4/20 0.47

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
SCHEMBL7302739 0.86 CDC25A (0.47) CDC25AICMTCNR2CNR1
SCHEMBL4054224 0.77 CNR1 (0.43) CNR2CNR1
SCHEMBL11786609 0.76 HTR6 (0.54)
SCHEMBL4054110 0.75 CNR2 (0.45) CNR2CNR1
SCHEMBL7712112 0.74 CNR2 (0.59) CDC25AICMTCNR2CNR1
Hydrochloric Acid SCHEMBL11844003 0.74 HTR6 (0.52)
SCHEMBL7712109 0.73 CDC25A (0.56) CDC25AICMTCNR2CNR1
SCHEMBL13131369 0.73 CDC25A (0.72) CDC25AICMTCNR2CNR1
SCHEMBL8363931 0.73 CDC25A (0.59) CDC25AICMTCNR2CNR1
SCHEMBL14947367 0.73 CDC25A (0.59) CDC25AICMTCNR2CNR1

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
US-5462948-A Treatment of addiction to drugs and substances of abuse H. LUNDBECK A/S (DK) 1995-10-31 US disclosed