SCHEMBL24345855

SCHEMBL24345855

COc1cc(C(=O)NC[C@](O)(c2cc3c(c(-c4ccc(F)cc4)n2)OC[C@]3(C)n2cccc2)C(F)(F)F)cc2cccnc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
GABRA5 P31644 2/20 0.31
CFTR P13569 3/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
NAMPT P43490 2/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
BTK Q06187 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
SCHEMBL24345670 1.00 POLB (0.36) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL29620701 1.00 POLB (0.36) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL24345453 0.94 POLB (0.35) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL29620711 0.94 POLB (0.35) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL24345268 0.94 POLB (0.35) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL29620699 0.94 POLB (0.34) POLBMEN1HPGDKMT2AMAPK13
SCHEMBL24345439 0.94 POLB (0.34) POLBMEN1HPGDKMT2AMAPK13
SCHEMBL24345459 0.92 POLB (0.39) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL24345669 0.90 POLB (0.38) POLBMEN1HPGDKMT2AGABRA5
SCHEMBL24345270 0.90 POLB (0.38) POLBMEN1HPGDKMT2AGABRA5

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 3294/4885MEN1 1492/4885HPGD 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.