SCHEMBL21628577

SCHEMBL21628577

CCCCCc1ccc(Oc2ncc(C(=O)N(C)C)cc2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 3/20 0.45
TRPV1 Q8NER1 1/20 0.43
RARB P10826 3/20 0.42
THRB P10828 2/20 0.40
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
STAT3 P40763 1/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
THRA P10827 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
SCHEMBL21628638 0.99 PLA2G4A (0.46) PLA2G4ATRPV1RARBTHRBICAM1
SCHEMBL21628763 0.97 PLA2G4A (0.41) PLA2G4ATRPV1RARBLPAR1LPAR5
SCHEMBL21628586 0.92 ALDH1A1 (0.41) PLA2G4ATHRBALDH1A1HPGDSMN1; SMN2
SCHEMBL21628886 0.88 RARB (0.53) PLA2G4ARARBRARARARGALDH1A1
SCHEMBL21628376 0.88 SMN1; SMN2 (0.43) ALDH1A1HPGDSMN1; SMN2
SCHEMBL21628429 0.87 RARB (0.55) PLA2G4ARARBRARARARGALDH1A1
SCHEMBL21628609 0.87 ICAM1 (0.48) PLA2G4ARARBTHRBICAM1SELE
SCHEMBL21628454 0.86 ICAM1 (0.49) PLA2G4ARARBTHRBICAM1SELE
SCHEMBL21628478 0.86 MAPT (0.50) RARBTHRBRARARARGSMN1; SMN2
SCHEMBL21628473 0.85 MAPT (0.49) PLA2G4ARARBICAM1SELERARA

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 PLA2G4A 4624/4885TRPV1 577/4885RARB 1144/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PLA2G4A 4624/4885TRPV1 577/4885RARB 1144/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK PLA2G4A 4706/4885TRPV1 741/4885RARB 1064/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PLA2G4A 4624/4885TRPV1 577/4885RARB 1144/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR PLA2G4A 4521/4885TRPV1 1387/4885RARB 1531/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PLA2G4A 4624/4885TRPV1 577/4885RARB 1144/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK PLA2G4A 4624/4885TRPV1 577/4885RARB 1144/4885

“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.