SCHEMBL12169523

SCHEMBL12169523

CCN(CCO)c1nc(N(CC)CCO)nc(N(CC)CCO)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 16/20 0.64
TSHR P16473 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
HTT P42858 1/20 0.42
USP2 O75604 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
PDE2A O00408 1/20 0.39
RGS12 O14924 1/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
ABCC4 O15439 1/20 0.39
ABCC5 O15440 1/20 0.39
PDE6D O43924 1/20 0.39
PDE8A O60658 1/20 0.39
GMNN O75496 1/20 0.39
PDE5A O76074 1/20 0.39
ABCB11 O95342 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL11766019 0.93 SLC29A1 (0.68) SLC29A1TSHRTDP1HTTUSP2
SCHEMBL15789173 0.85 SLC29A1 (0.59) SLC29A1TSHRTDP1HTTUSP2
SCHEMBL1035062 0.84 SLC29A1 (0.58) SLC29A1TSHRTDP1USP2KDM4E
SCHEMBL13034401 0.83 SLC29A1 (0.53) SLC29A1TDP1HTTMEN1ALDH1A1
SCHEMBL11766055 0.82 SLC29A1 (0.52) SLC29A1TSHRTDP1HTTUSP2
SCHEMBL11766112 0.82 SLC29A1 (0.52) SLC29A1TSHRTDP1HTTUSP2
SCHEMBL17857263 0.80 SLC29A1 (0.54) SLC29A1TSHRTDP1HTTUSP2
SCHEMBL2841753 0.79 SLC29A1 (0.57) SLC29A1TSHRTDP1USP2KDM4E
SCHEMBL14511082 0.79 SLC29A1 (0.49) SLC29A1HTTCYP2C9HPGDHIF1A
SCHEMBL11767936 0.78 SLC29A1 (0.53) SLC29A1TSHRTDP1USP2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8828565-B2 Lubricant composition, fluorine-based compound, and use thereof FUJIFILM CORPORATION (JP) 2014-09-09 US disclosed
US-20120231297-A1 LUBRICANT COMPOSITION, FLUORINE-BASED COMPOUND, AND USE THEREOF FUJIFILM CORPORATION (JP) 2012-09-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120231297-A1 LUBRICANT COMPOSITION, FLUORINE-BASED COMPOUND, AND USE THEREOF F12, F2, F11 SLC29A1 437/4885TSHR 3889/4885TDP1 248/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.