SCHEMBL21628462

SCHEMBL21628462

O=C(O)c1ccc(Oc2ccc(C3CCCCCC3)cc2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.49
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
HAO1 Q9UJM8 1/20 0.43
TTR P02766 1/20 0.43
OPRK1 P41145 6/20 0.42
OPRM1 P35372 5/20 0.42
OPRD1 P41143 5/20 0.42
STAT3 P40763 1/20 0.42
LPAR1 Q92633 1/20 0.42
LPAR5 Q9H1C0 1/20 0.42
CASP1 P29466 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL21628714 1.00 KMO (0.49) KMORAB9ALMNAMAPK1HTT
SCHEMBL21628681 0.99 LMNA (0.49) KMORAB9ALMNAMAPK1HTT
SCHEMBL21628394 0.96 LMNA (0.49) KMORAB9ALMNAMAPK1HTT
SCHEMBL21628536 0.93 LMNA (0.51) RAB9ALMNAMAPK1HTTMRGPRX4
SCHEMBL21628396 0.89 OPRK1 (0.53) ALDH1A1OPRK1OPRM1OPRD1MAPT
SCHEMBL21628783 0.89 OPRK1 (0.53) ALDH1A1OPRK1OPRM1OPRD1MAPT
SCHEMBL21628791 0.87 OPRK1 (0.54) ALDH1A1KMT2AOPRK1OPRM1OPRD1
SCHEMBL21628766 0.86 ALDH1A1 (0.47) ALDH1A1KMT2AHAO1OPRK1OPRM1
SCHEMBL21628661 0.86 HDAC6 (0.58) HAO1OPRK1OPRM1OPRD1STAT3
SCHEMBL21628529 0.86 ALDH1A1 (0.47) ALDH1A1KMT2AHAO1OPRK1OPRM1

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 KMO 82/4885RAB9A 2955/4885LMNA 3327/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK KMO 82/4885RAB9A 2955/4885LMNA 3327/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK KMO 104/4885RAB9A 3345/4885LMNA 3083/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK KMO 82/4885RAB9A 2955/4885LMNA 3327/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR KMO 985/4885RAB9A 3981/4885LMNA 832/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK KMO 82/4885RAB9A 2955/4885LMNA 3327/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK KMO 82/4885RAB9A 2955/4885LMNA 3327/4885

“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.