SCHEMBL4482096

SCHEMBL4482096

Nc1ccc(N)c(C2CCCCCCCCC2)c1C1CCCCCCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
BACE1 P56817 2/20 0.36
CYP11B2 P19099 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GFER P55789 1/20 0.33
ADK P55263 1/20 0.33
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
ABCB1 P08183 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
NUDT1 P36639 1/20 0.32

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
SCHEMBL3692132 1.00 TDO2 (0.38) TDO2KDM4EMAPTGAABACE1
SCHEMBL247757 1.00 TDO2 (0.38) TDO2KDM4EMAPTGAABACE1
SCHEMBL4478730 0.86 PTGS1 (0.33) SMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL1498800 0.83 TDO2 (0.39) TDO2KDM4EMAPTGAABACE1
SCHEMBL1498733 0.80 KDM4E (0.34) TDO2KDM4EMAPTGAAADK
SCHEMBL3688474 0.78 ALOX15 (0.37) KDM4EMAPTGAAALDH1A1GFER
SCHEMBL11586085 0.78 CYP1B1 (0.42) KDM4EMAPTGAABACE1SMN1; SMN2
SCHEMBL5680295 0.78 HPGD (0.41) TDO2KDM4EMAPTGAANPC1
SCHEMBL620017 0.78 TDO2 (0.39) TDO2KDM4EMAPTGAABACE1
SCHEMBL2656264 0.78 HTR2C (0.38) TP53

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-20090156441-A1 Cycloalkyl phenylenediamines as deposit control agents for lubricants GREAT LAKES CHEMICAL GLOBAL, INC. 2009-06-18 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-20090156441-A1 Cycloalkyl phenylenediamines as deposit control agents for lubricants C5, C9, C1S TDO2 498/4885KDM4E 4043/4885MAPT 2214/4885

“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.