SCHEMBL9801204

SCHEMBL9801204

CCN1CCN(CCCO)CC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 1/20 0.37
CHRM1 P11229 1/20 0.33
TSHR P16473 1/20 0.31
S1PR4 O95977 1/20 0.30
S1PR1 P21453 1/20 0.30
S1PR3 Q99500 1/20 0.30
S1PR5 Q9H228 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
SCHEMBL9800985 0.89 ALDH1A1 (0.35) SLC29A1CHRM1
SCHEMBL9801563 0.89 SLC29A1 (0.44) SLC29A1TSHR
SCHEMBL9801387 0.88 SLC29A1 (0.39) SLC29A1TSHRS1PR4S1PR1S1PR3
SCHEMBL9801317 0.87 SLC29A1 (0.40) SLC29A1TSHR
SCHEMBL27598282 0.83 SLC29A1 (0.34) SLC29A1
SCHEMBL9801616 0.83 SLC29A1 (0.38) SLC29A1
SCHEMBL9801699 0.82 KEAP1 (0.37) SLC29A1
SCHEMBL9801595 0.81 SLC29A1 (0.40) SLC29A1
SCHEMBL7902209 0.81 HTR1A (0.33) SLC29A1CHRM1
SCHEMBL9801159 0.79 TSHR (0.33) SLC29A1TSHR

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