SCHEMBL30947337

SCHEMBL30947337

CCCCOc1nc(CNCCCCCN2CCCC2)c(NC(=O)OC(C)(C)C)c(N(Cc2ccc(OC)cc2)Cc2ccc(OC)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
DRD2 P14416 2/20 0.36
KMT2A Q03164 1/20 0.35
BCHE P06276 3/20 0.35
ACHE P22303 3/20 0.35
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL24733112 1.00 POLB (0.36) POLBMAPTDRD2KMT2ABCHE
SCHEMBL27213626 0.91 POLB (0.40) POLBMAPTKMT2ABCHEACHE
SCHEMBL24732885 0.89 TSHR (0.38) MAPTKMT2AHRH3
SCHEMBL24732683 0.87 MEN1 (0.36) MAPTKMT2ABCHEACHEHRH3
SCHEMBL30947353 0.87 MEN1 (0.36) MAPTKMT2ABCHEACHEHRH3
SCHEMBL24732772 0.87 CYP2D6 (0.38) MAPTKMT2A
SCHEMBL24732845 0.86 CACNA1B (0.34) MAPT
SCHEMBL24732916 0.85 TLR7 (0.39) MAPT
SCHEMBL30947335 0.85 TLR7 (0.39) MAPT
SCHEMBL24732866 0.85 PTGDR (0.35) HRH3

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-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF INNOVSTONE THERAPEUTICS LIMITED (CN) 2024-05-09 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-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF TLR7, TLR1, TLR8 POLB 2806/4885MAPT 4042/4885DRD2 2701/4885

“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.