SCHEMBL2831772

SCHEMBL2831772

CCCCCCCCc1ccccc1-c1ccccc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.51
NR1H2 P55055 1/20 0.50
NR1H3 Q13133 1/20 0.50
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
GCGR P47871 1/20 0.45
TLR8 Q9NR97 1/20 0.44
GPR3 P46089 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.42
PTPN1 P18031 1/20 0.41
BID P55957 3/20 0.41

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
SCHEMBL27864911 1.00 LIPG (0.51) LIPGNR1H2NR1H3CNR1CNR2
SCHEMBL27839133 1.00 LIPG (0.51) LIPGNR1H2NR1H3CNR1CNR2
SCHEMBL27688479 0.98 LIPG (0.49) LIPGNR1H2NR1H3CNR1CNR2
SCHEMBL1154593 0.96 LIPG (0.47) LIPGNR1H2NR1H3CNR1CNR2
SCHEMBL27498291 0.93 ALDH1A1 (0.50) LIPGNR1H2NR1H3CNR1CNR2
SCHEMBL27456996 0.91 ALDH1A1 (0.48) LIPGNR1H2NR1H3CNR1CNR2
SCHEMBL8157124 0.89 LIPG (0.62) LIPGNR1H2NR1H3GPR3PTPN1
SCHEMBL9619382 0.89 LIPG (0.62) LIPGNR1H2NR1H3GPR3PTPN1
SCHEMBL11663988 0.89 LIPG (0.62) LIPGNR1H2NR1H3GPR3PTPN1
SCHEMBL1414266 0.89 LIPG (0.62) LIPGNR1H2NR1H3GPR3PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102782103-B Lubricating oil composition IDEMITSU KOSAN CO 2015-04-29 CN disclosed
CN-102597194-B Lubricating oil composition IDEMITSU KOSAN CO 2014-12-31 CN disclosed
US-20100109517-A1 PYRENE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-05-06 US disclosed
EP-2147944-A1 PYRENE POLYMER AND LUMINESCENT ELEMENT MADE WITH THE SAME Sumitomo Chemical Company, Limited (JP) 2010-01-27 EP 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-20100109517-A1 PYRENE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME TERB1, AHR, CYP1A1 LIPG 4317/4885NR1H2 463/4885NR1H3 637/4885

“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.