SCHEMBL13225083

SCHEMBL13225083

CCC(C)COCCCCON

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
HTT P42858 1/20 0.37
CYP3A4 P08684 2/20 0.36
USP2 O75604 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34
ODC1 P11926 1/20 0.33
LPAR1 Q92633 5/20 0.33
LPAR3 Q9UBY5 5/20 0.33
LPAR2 Q9HBW0 4/20 0.33
LPAR6 P43657 3/20 0.33
LPAR4 Q99677 3/20 0.33
LPAR5 Q9H1C0 3/20 0.33
HSD17B10 Q99714 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
PRKD3 O94806 1/20 0.30
PRKCG P05129 1/20 0.30
PRKCB P05771 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
SCHEMBL17126850 0.86 USP2 (0.43) HTTCYP3A4USP2SPHK1LPAR1
SCHEMBL12582706 0.82 USP2 (0.50) HTTCYP3A4USP2SPHK1LPAR1
SCHEMBL23851234 0.80 USP2 (0.53) HTTUSP2SPHK1LPAR1LPAR3
SCHEMBL18019302 0.80 USP2 (0.53) HTTUSP2SPHK1LPAR1LPAR3
SCHEMBL18290924 0.80 TSHR (0.44) HTTCYP3A4USP2SPHK1LPAR1
SCHEMBL14262302 0.80 LPAR1 (0.37) HTTCYP3A4USP2SPHK1LPAR1
SCHEMBL28848149 0.80 USP2 (0.53) HTTUSP2SPHK1LPAR1LPAR3
SCHEMBL12201729 0.80 CYP3A4 (0.55) HTTCYP3A4USP2SPHK1ODC1
SCHEMBL14952421 0.79 CYP3A4 (0.44) ADRB2ADRB1ADRB3HTTCYP3A4
SCHEMBL12587449 0.79 CYP3A4 (0.44) ADRB2ADRB1ADRB3HTTCYP3A4

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-20100197573-A1 Transglutaminase Mediated Conjugation of Growth Hormone NOVO NORDISK HEALTH CARE AG (CH) 2010-08-05 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-20100197573-A1 Transglutaminase Mediated Conjugation of Growth Hormone TGM2, GHITM, GHRHR ADRB2 4186/4885ADRB1 4107/4885ADRB3 3988/4885

“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.