SCHEMBL21628659

SCHEMBL21628659

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

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.52
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP1A2 P05177 2/20 0.44
POLB P06746 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
PTGS2 P35354 1/20 0.42
F10 P00742 1/20 0.42
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
P2RX3 P56373 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
P2RY12 Q9H244 1/20 0.41

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
SCHEMBL21628642 0.91 MAOB (0.48) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL14656159 0.89 P2RY12 (0.44) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL21628788 0.88 S1PR1 (0.48) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL21628761 0.88 MAOB (0.46) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL20827025 0.88 MAOB (0.47) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL21628567 0.88 MAOB (0.57) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL21628677 0.87 S1PR1 (0.45) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL21628625 0.87 TDP1 (0.46) L3MBTL1LMNAALDH1A1TDP1MAPT
SCHEMBL21628869 0.86 MAOB (0.40) MAOBCYP2C9CYP2C19CYP1A2POLB
SCHEMBL21628397 0.86 MAOB (0.48) MAOBCYP2C9CYP2C19CYP1A2POLB

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 2110/4885CYP2C9 1021/4885CYP2C19 1208/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885CYP2C9 1021/4885CYP2C19 1208/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK MAOB 2399/4885CYP2C9 1097/4885CYP2C19 1226/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885CYP2C9 1021/4885CYP2C19 1208/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR MAOB 1042/4885CYP2C9 624/4885CYP2C19 1138/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885CYP2C9 1021/4885CYP2C19 1208/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAOB 2110/4885CYP2C9 1021/4885CYP2C19 1208/4885

“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.