SCHEMBL3450443

SCHEMBL3450443

CCOC(=O)C1CN(Cc2ccccc2)CC1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 4/20 0.47
SIGMAR1 Q99720 2/20 0.45
CCR8 P51685 1/20 0.45
KDM4E B2RXH2 4/20 0.44
S1PR5 Q9H228 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
S1PR1 P21453 1/20 0.43
MAPK1 P28482 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
SCHEMBL7545492 1.00 USP30 (0.53) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL7545508 1.00 USP30 (0.53) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL1055082 0.88 USP30 (0.62) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL14037432 0.88 USP30 (0.62) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL853539 0.88 USP30 (0.62) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL13177349 0.88 USP30 (0.62) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL853540 0.88 USP30 (0.62) USP30L3MBTL1ATMALDH1A1SIGMAR1
SCHEMBL1718729 0.87 S1PR5 (0.45) USP30SIGMAR1S1PR5S1PR1
SCHEMBL1718731 0.87 S1PR5 (0.45) USP30SIGMAR1S1PR5S1PR1
SCHEMBL1891026 0.85 USP30 (0.54) USP30L3MBTL1ATMALDH1A1SIGMAR1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339960-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER (US) 2023-10-26 US disclosed
US-11702424-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2023-07-18 US disclosed
EP-3536685-B1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AND THEIR USE AS IRAK4 INHIBITORS PFIZER (US) 2022-02-16 EP disclosed
US-20200377511-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2020-12-03 US disclosed
US-10793579-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2020-10-06 US disclosed
EP-3536685-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AND THEIR USE AS IRAK4 INHIBITORS Pfizer Inc (US) 2019-09-11 EP disclosed
US-20190270751-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2019-09-05 US disclosed
US-10329302-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2019-06-25 US disclosed
US-20180127432-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2018-05-10 US disclosed
US-9879022-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2018-01-30 US disclosed
US-6372764-B1 ANTIINFLAMMATORY AGENTS AND AIDS TREATMENT MERCK & CO., INC. 2002-04-16 US disclosed
EP-0726269-B1 QUINOLINECARBOXYLIC ACID DERIVATIVES AND SALTS THEREOF KAKEN PHARMA CO LTD (JP) 2001-09-05 EP disclosed
WO-2000051609-A1 3-ALKYL SUBSTITUTED PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY MERCK & CO., INC. (US) 2000-09-08 WO disclosed
WO-2000051610-A1 PYRROLIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY MERCK & CO., INC. (US) 2000-09-08 WO disclosed
US-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 US disclosed
US-5668147-A ANTIBIOTICS, BACTERICIDES KAKEN PHARMACEUTICAL CO., LTD. (JP) 1997-09-16 US disclosed
US-5599816-A BACTERICIDE ABBOTT LABORATORIES (US) 1997-02-04 US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 WO disclosed
US-5580872-A ADMINISTERING IN THE TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1996-12-03 US disclosed
EP-0726269-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE AND SALT THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 1996-08-14 EP 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-20190270751-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 USP30 4453/4885L3MBTL1 4668/4885ATM 1496/4885
US-20200377511-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 USP30 4453/4885L3MBTL1 4668/4885ATM 1496/4885
US-10793579-B2 Bicyclic-fused heteroaryl or aryl compounds UGT2B7, CYP3A43, CYP3A4 USP30 4453/4885L3MBTL1 4668/4885ATM 1496/4885
US-20230339960-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds TTR, TYR, ABL1 USP30 3230/4885L3MBTL1 3017/4885ATM 949/4885
US-10329302-B2 Bicyclic-fused heteroaryl or aryl compounds UGT2B7, CYP3A43, CYP3A4 USP30 4453/4885L3MBTL1 4668/4885ATM 1496/4885
US-20180127432-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 USP30 4453/4885L3MBTL1 4668/4885ATM 1496/4885
US-11702424-B2 Bicyclic-fused heteroaryl or aryl compounds UGT2B7, CYP3A43, CYP3A4 USP30 4453/4885L3MBTL1 4668/4885ATM 1496/4885

“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.