SCHEMBL21628504

SCHEMBL21628504

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.49
SLC6A4 P31645 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MMP13 P45452 1/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
RAF1 P04049 2/20 0.42
MAPK1 P28482 1/20 0.42
PLK1 P53350 2/20 0.41
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
IGFBP3 P17936 1/20 0.40
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
S1PR2 O95136 1/20 0.39

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
SCHEMBL21628471 0.96 SLC6A2 (0.48) SLC6A2SLC6A4HPGDTSHRHTT
SCHEMBL21628649 0.93 HPGD (0.51) SLC6A2SLC6A4HPGDTSHRHTT
SCHEMBL21628613 0.89 OPRM1 (0.43) MAPTKDM4EMAPK1KCNQ3KCNQ2
SCHEMBL21628492 0.88 HPGD (0.51) SLC6A2SLC6A4HPGDTSHRHTT
SCHEMBL21628694 0.88 MAPT (0.54) SLC6A2SLC6A4HPGDTSHRHTT
SCHEMBL21628705 0.87 ALDH1A1 (0.49) SLC6A2SLC6A4HPGDHTTMAPT
SCHEMBL21628820 0.86 HPGD (0.67) SLC6A2SLC6A4HPGDTSHRHTT
SCHEMBL21628670 0.86 OPRM1 (0.43) SLC6A2SLC6A4MAPTKDM4EMAPK1
SCHEMBL21657035 0.85 HPGD (0.54) SLC6A2SLC6A4HPGDTSHRHTT
SCHEMBL21628798 0.85 LMNA (0.49) HTTMAPTKDM4EMAPK1KCNQ3

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 SLC6A2 2765/4885SLC6A4 3395/4885HPGD 2579/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK SLC6A2 2765/4885SLC6A4 3395/4885HPGD 2579/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK SLC6A2 3104/4885SLC6A4 3517/4885HPGD 2313/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK SLC6A2 2765/4885SLC6A4 3395/4885HPGD 2579/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR SLC6A2 4255/4885SLC6A4 4528/4885HPGD 3694/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK SLC6A2 2765/4885SLC6A4 3395/4885HPGD 2579/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK SLC6A2 2765/4885SLC6A4 3395/4885HPGD 2579/4885

“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.