SCHEMBL24345859

SCHEMBL24345859

COc1cc(C(=O)NCC(O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@]3(C)/C=N/O)C(F)(F)F)cc2cccnc12

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 5/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
CFTR P13569 3/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
RECQL P46063 1/20 0.31
GABRA5 P31644 2/20 0.31
NAMPT P43490 2/20 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
SCHEMBL24345301 0.95 POLB (0.36) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24345298 0.94 POLB (0.37) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24345459 0.92 POLB (0.39) POLBKMT2AMEN1HPGDMAPT
SCHEMBL18033219 0.90 POLB (0.38) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24345669 0.90 POLB (0.38) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24345270 0.90 POLB (0.38) POLBKMT2AMEN1HPGDMAPT
SCHEMBL23905669 0.89 POLB (0.36) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24345299 0.89 POLB (0.36) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24345458 0.89 POLB (0.37) POLBKMT2AMEN1HPGDMAPT
SCHEMBL24986796 0.89 POLB (0.37) POLBKMT2AMEN1HPGDMAPT

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 POLB 3294/4885KMT2A 2438/4885MEN1 1492/4885

“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.