SCHEMBL21628393

SCHEMBL21628393

COC(=O)c1cnc(Oc2ccc(C3CCC3)cc2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.45
FEN1 P39748 3/20 0.45
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PROKR1 Q8TCW9 4/20 0.37
STAT3 P40763 1/20 0.37
LMNA P02545 1/20 0.37
TNK2 Q07912 1/20 0.37
TRPC6 Q9Y210 1/20 0.36
MAPK1 P28482 1/20 0.35
HAO1 Q9UJM8 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
SCHEMBL21628687 0.98 ALOX5AP (0.43) ALOX5APFEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL21628488 0.97 SMN1; SMN2 (0.42) ALOX5APFEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL21628383 0.97 SMN1; SMN2 (0.42) ALOX5APFEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL21628578 0.95 ALOX5AP (0.40) ALOX5APFEN1LMNATRPC6MAPK1
SCHEMBL21628556 0.88 MAPT (0.41) ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL21656946 0.88 SCN9A (0.43) ALOX5APFEN1SMN1; SMN2PROKR1STAT3
SCHEMBL21628405 0.87 FEN1 (0.42) ALOX5APFEN1SMN1; SMN2HAO1
SCHEMBL21628664 0.86 HDAC6 (0.49) STAT3
SCHEMBL21628753 0.86 PARP10 (0.46) ALOX5APFEN1
SCHEMBL21628453 0.86 MAPT (0.43) ALDH1A1MAPTSMN1; SMN2LMNA

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 ALOX5AP 3143/4885FEN1 4361/4885ALDH1A1 717/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK ALOX5AP 3143/4885FEN1 4361/4885ALDH1A1 717/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK ALOX5AP 3337/4885FEN1 4128/4885ALDH1A1 900/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK ALOX5AP 3143/4885FEN1 4361/4885ALDH1A1 717/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR ALOX5AP 3839/4885FEN1 1122/4885ALDH1A1 929/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK ALOX5AP 3143/4885FEN1 4361/4885ALDH1A1 717/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK ALOX5AP 3143/4885FEN1 4361/4885ALDH1A1 717/4885

“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.