SCHEMBL12746147

SCHEMBL12746147

N#Cc1cccc(-c2ccc3c(c2)C(=O)CS3(=O)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 7/20 0.49
CHEK1 O14757 1/20 0.44
XDH P47989 1/20 0.42
SLC22A12 Q96S37 1/20 0.42
PRF1 P14222 1/20 0.41
VEGFA P15692 1/20 0.40
AR P10275 1/20 0.40
PDK2 Q15119 1/20 0.40
PTPN5 P54829 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
ADRA2C P18825 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
MAOB P27338 2/20 0.39
MAP4K4 O95819 1/20 0.36

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
SCHEMBL12746139 0.81 VEGFA (0.47) VEGFACLK4MAOB
SCHEMBL12745919 0.75 CHEK1 (0.50) PGRCHEK1XDHSLC22A12AR
SCHEMBL12746153 0.74 TDP2 (0.47) PGRCHEK1VEGFAHRH3CLK4
SCHEMBL12746145 0.74 GSTP1 (0.47) VEGFAMAOB
SCHEMBL2154026 0.71 CLK4 (0.65) PGRXDHSLC22A12PTPN5ADRA2C
SCHEMBL4423216 0.70 PGR (0.56) PGRCHEK1XDHSLC22A12PRF1
SCHEMBL12746146 0.70 VEGFA (0.43) CHEK1PRF1VEGFAPDK2
SCHEMBL12746160 0.69 VEGFA (0.43) VEGFAAR
SCHEMBL12746142 0.69 GSTP1 (0.49) MAOB
SCHEMBL27787243 0.69 CLK4 (0.63) PGRXDHSLC22A12PTPN5ADRA2C

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-20110071178-A1 Methods and Compounds for Modulating Cannabinoid Activity NORTHEASTERN UNIVERSITY (US) 2011-03-24 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-20110071178-A1 Methods and Compounds for Modulating Cannabinoid Activity FAAH, FAAH2, CNR2 PGR 2116/4885CHEK1 3378/4885XDH 799/4885

“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.