SCHEMBL9801809

SCHEMBL9801809

CCCN1CCN(CCC(C)O)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.39
SIGMAR1 Q99720 2/20 0.39
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
GBA1 P04062 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 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
SCHEMBL9319178 0.90 HRH3 (0.38) DRD2SMN1; SMN2HRH3
SCHEMBL9801680 0.86 KDM4E (0.35) SIGMAR1TSHRSMN1; SMN2HRH3
SCHEMBL9801473 0.84 DRD2 (0.44) DRD2SIGMAR1
SCHEMBL24319340 0.83 GAA (0.41) SIGMAR1SMN1; SMN2HRH3
SCHEMBL9801142 0.83 GAA (0.41) SIGMAR1SMN1; SMN2HRH3
SCHEMBL25304200 0.83 GAA (0.41) SIGMAR1SMN1; SMN2HRH3
SCHEMBL13412960 0.83 DRD2 (0.41) DRD2SIGMAR1GNAI3GNAO1GNAI1
SCHEMBL9801052 0.81 KMT2A (0.48) TSHR
SCHEMBL3271095 0.80 HRH3 (0.46) HRH3
SCHEMBL9801683 0.79 OPRM1 (0.41) DRD2SIGMAR1GNAI3GNAO1GNAI1

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-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed