SCHEMBL24345303

SCHEMBL24345303

COc1cc(C(=O)NC[C@](O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@H]3C)C2CC2)cc2scnc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
GAA P10253 1/20 0.31
GABRA5 P31644 2/20 0.31
LRRK2 Q5S007 1/20 0.30
CFTR P13569 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 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
SCHEMBL24345713 0.92 CFTR (0.31) MAPTALDH1A1HPGDMAPK1GAA
SCHEMBL24346367 0.89 CFTR (0.33) MAPTALDH1A1HPGDMAPK1CFTR
SCHEMBL24363729 0.87 POLB (0.38) MAPTALDH1A1HPGDCFTRPOLB
SCHEMBL24345444 0.85 CSNK1D (0.34)
SCHEMBL23717296 0.84 CFTR (0.31) MAPTALDH1A1HPGDMAPK1GABRA5
SCHEMBL23717303 0.84 CFTR (0.31) MAPTALDH1A1HPGDMAPK1GABRA5
SCHEMBL24363615 0.84 MEN1 (0.37) ALDH1A1KMT2A
SCHEMBL23717101 0.83 CFTR (0.34) CFTR
SCHEMBL24345326 0.82 ALDH1A1 (0.30) MAPTALDH1A1HPGDMAPK1
SCHEMBL24345318 0.82 ALDH1A1 (0.30) MAPTALDH1A1HPGDMAPK1

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-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-04-21 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-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN MAPT 4216/4885ALDH1A1 1686/4885HPGD 36/4885

“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.