SCHEMBL21628397

SCHEMBL21628397

CCOC(=O)c1cnc(Oc2ccc(C(F)(F)C(F)(F)F)cc2)c(F)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.48
POLB P06746 3/20 0.39
CYP1A2 P05177 3/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 1/20 0.39
P2RX3 P56373 1/20 0.38
F10 P00742 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL21628758 0.94 MAOB (0.46) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628631 0.93 MAOB (0.46) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628678 0.91 MAOB (0.50) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628567 0.91 MAOB (0.57) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL20827025 0.89 MAOB (0.47) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628667 0.87 LMNA (0.49) L3MBTL1LMNAALDH1A1MAPT
SCHEMBL21628706 0.87 MAOB (0.45) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628659 0.86 MAOB (0.52) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628642 0.85 MAOB (0.48) MAOBPOLBCYP1A2CYP2C9CYP2C19
SCHEMBL21628804 0.83 PTGER4 (0.45)

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 MAOB 2110/4885POLB 3699/4885CYP1A2 458/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885POLB 3699/4885CYP1A2 458/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK MAOB 2399/4885POLB 2979/4885CYP1A2 425/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885POLB 3699/4885CYP1A2 458/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR MAOB 1042/4885POLB 814/4885CYP1A2 724/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885POLB 3699/4885CYP1A2 458/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885POLB 3699/4885CYP1A2 458/4885

“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.