SCHEMBL23918008

SCHEMBL23918008

CCCCc1cn(CCCCCCCCCCC(C)C)nn1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 12/20 0.53
HRH4 Q9H3N8 2/20 0.51
HRH3 Q9Y5N1 2/20 0.51
EPHX2 P34913 1/20 0.49
CYP19A1 P11511 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
GGPS1 O95749 1/20 0.43

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
SCHEMBL21671071 1.00 GBA1 (0.53) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL3533255 1.00 GBA1 (0.53) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL18391502 0.98 GBA1 (0.51) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL18489275 0.96 HRH4 (0.56) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL22762136 0.96 HRH4 (0.56) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL19300362 0.96 HRH4 (0.56) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL18493347 0.96 HRH4 (0.56) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL18494157 0.96 HRH4 (0.56) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL19479091 0.96 HRH4 (0.56) GBA1HRH4HRH3EPHX2CYP19A1
SCHEMBL5021139 0.94 HRH4 (0.54) GBA1HRH4HRH3EPHX2CYP19A1

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-20210317521-A1 TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION Roche Sequencing Solutions, Inc. (US) 2021-10-14 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-20210317521-A1 TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION PHAX, POLRMT, POLN GBA1 3370/4885HRH4 4300/4885HRH3 3737/4885

“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.