SCHEMBL20042027

SCHEMBL20042027

CCCNCc1cn(CCC)nn1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 16/20 0.47
CYP19A1 P11511 1/20 0.38

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
SCHEMBL14924263 0.81 GBA1 (0.44) GBA1CYP19A1
SCHEMBL26431298 0.80 GBA1 (0.49) GBA1
SCHEMBL21507161 0.79 GBA1 (0.45) GBA1CYP19A1
SCHEMBL1753962 0.79 GBA1 (0.45) GBA1CYP19A1
SCHEMBL25704385 0.78 GBA1 (0.44) GBA1
SCHEMBL27307845 0.77 GBA1 (0.46) GBA1
SCHEMBL5021089 0.77 CYP19A1 (0.59) GBA1CYP19A1
SCHEMBL14925315 0.76 GBA1 (0.42) GBA1CYP19A1
SCHEMBL12224107 0.76 GBA1 (0.43) GBA1CYP19A1
SCHEMBL22280504 0.76 GBA1 (0.43) GBA1CYP19A1

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-20180100146-A1 HIGH-SPEED PHOTO-CROSS-LINKING LINKER FOR MOLECULAR INTERACTION ANALYSIS AND IN VITRO SELECTION, AND IN VITRO SELECTION METHOD USING LINKER SAITAMA UNIVERSITY (JP) 2018-04-12 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-20180100146-A1 HIGH-SPEED PHOTO-CROSS-LINKING LINKER FOR MOLECULAR INTERACTION ANALYSIS AND IN VITRO SELECTION, AND IN VITRO SELECTION METHOD USING LINKER RTCB, CPSF1, CPSF7 GBA1 4586/4885CYP19A1 3598/4885

“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.