SCHEMBL21628699

SCHEMBL21628699

NC(=O)c1cnc(Oc2ccc(C3CCCCCC3)cc2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 7/20 0.45
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
SIRT3 Q9NTG7 1/20 0.43
PARP14 Q460N5 2/20 0.42
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
HAO1 Q9UJM8 1/20 0.41
PARP15 Q460N3 2/20 0.40
BTK Q06187 4/20 0.39
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EGFR P00533 2/20 0.38

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
SCHEMBL21628418 1.00 PARP10 (0.45) PARP10SIRT2SIRT1SIRT3PARP14
SCHEMBL21628434 0.99 PARP10 (0.46) PARP10SIRT2SIRT1SIRT3PARP14
SCHEMBL21628753 0.96 PARP10 (0.46) PARP10SIRT2SIRT1SIRT3PARP14
SCHEMBL21628849 0.94 PARP10 (0.47) PARP10SIRT2SIRT1SIRT3PARP14
SCHEMBL20482060 0.89 KMT2A (0.45) ALOX5APFEN1HAO1KDM4EGLA
SCHEMBL21628889 0.89 KMT2A (0.45) ALOX5APFEN1HAO1KDM4EGLA
SCHEMBL21628737 0.88 KMT2A (0.43) ALOX5APFEN1HAO1KDM4EGLA
SCHEMBL21628383 0.86 SMN1; SMN2 (0.42) ALOX5APFEN1HAO1KDM4EGLA
SCHEMBL20482263 0.86 HDAC6 (0.51) HAO1KMT2A
SCHEMBL21628405 0.86 FEN1 (0.42) PARP10ALOX5APFEN1HAO1KDM4E

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 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 (7 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-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885SIRT2 3402/4885SIRT1 3601/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885SIRT2 3402/4885SIRT1 3601/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK PARP10 1897/4885SIRT2 3495/4885SIRT1 3835/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885SIRT2 3402/4885SIRT1 3601/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR PARP10 3512/4885SIRT2 3868/4885SIRT1 3806/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885SIRT2 3402/4885SIRT1 3601/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PARP10 1944/4885SIRT2 3402/4885SIRT1 3601/4885

“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.