SCHEMBL74877

SCHEMBL74877

CCOC(=O)N1CC[N]CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
POLB P06746 2/20 0.55
HTT P42858 1/20 0.55
GAA P10253 5/20 0.53
RECQL P46063 1/20 0.52
KDM4E B2RXH2 2/20 0.50
FAAH O00519 1/20 0.47
MGLL Q99685 1/20 0.47
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ABL1 P00519 1/20 0.47
RIN1 Q13671 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
THRB P10828 1/20 0.47
ATM Q13315 1/20 0.47
LMNA P02545 1/20 0.46
NOS3 P29474 1/20 0.45
NOS2 P35228 1/20 0.45

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
SCHEMBL2097634 0.92 TSHR (0.50) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL3953195 0.86 POLB (0.49) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL10985089 0.84 ALDH1A1 (0.72) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL1684895 0.84
SCHEMBL1937433 0.83 POLB (0.63) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL7510677 0.81 POLB (0.57) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL4561321 0.80 RAB9A (0.44) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL3313940 0.80 POLB (0.40) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL5543852 0.80 SMN1; SMN2 (0.44) TSHRALDH1A1SMN1; SMN2POLBHTT
SCHEMBL4687715 0.80 LMNA (0.55) TSHRALDH1A1SMN1; SMN2POLBFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190343814-A1 PYRAZOLOPYRIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2019-11-14 US claimed
EP-3402791-A1 SUBSTITUTED THIOHYDANTOIN DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS Janssen Pharmaceutica, N.V. (BE) 2018-11-21 EP claimed
WO-2018152220-A1 PYRAZOLOPYRIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION (US) 2018-08-23 WO claimed
US-10000502-B2 Substituted thiohydantoin derivatives as androgen receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2018-06-19 US claimed
US-20170233401-A1 SUBSTITUTED THIOHYDANTOIN DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2017-08-17 US claimed
WO-2017123542-A1 SUBSTITUTED THIOHYDANTOIN DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2017-07-20 WO claimed
EP-2091926-B1 SUBSTITUTED PYRAZOLE AND TRIAZOLE COMPOUNDS AS KSP INHIBITORS NOVARTIS AG (CH) 2015-10-21 EP claimed
EP-2794584-A1 BENZYL SULFONAMIDE DERIVATIVES AS RORc MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2014-10-29 EP claimed
US-8653081-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2014-02-18 US claimed
US-20130296335-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. 2013-11-07 US claimed
EP-1019367-A1 DERIVATIVES OF 2,5- AND 3,5-DISUBSTITUTED ANILINES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-07-19 EP claimed
WO-1999062905-A1 8-PHENYLXANTHINE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS ALMIRALL PRODESFARMA, S.A. (ES) 1999-12-09 WO claimed
WO-1999007672-A1 DERIVATIVES OF 2,5- AND 3,5-DISUBSTITUTED ANILINES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-02-18 WO claimed
US-5763438-A ANTIVIRAL AGENTS SEIKAGAKU CORPORATION (JP) 1998-06-09 US claimed
EP-0765865-A1 2-ACYLAMINOPROPANOL COMPOUND AND MEDICINAL COMPOSITION SEIKAGAKU CORPORATION (JP) 1997-04-02 EP claimed
EP-0196005-B1 PYRIDAZINONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1989-12-20 EP claimed
EP-0196005-A1 Pyridazinones, their preparation and pharmaceutical compositions containing them Dr. Karl Thomae GmbH (DE) 1986-10-01 EP claimed
US-4390697-A Process for the preparation of triazoloquinazolinones ROUSSEL UCLAF (FR) 1983-06-28 US claimed
US-4350695-A Antihistaminic and bronchospasmolytic triazoloquinazolinones ROUSSEL UCLAF (FR) 1982-09-21 US claimed
US-3939268-A 2,4-Diamino substituted pyridol(3,2-d)pyrimidine as antithrombotic agents BOEHRINGER INGELHEIM GMBH (DT) 1976-02-17 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20170233401-A1 SUBSTITUTED THIOHYDANTOIN DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS AR, SHBG, NR5A1 TSHR 70/4885ALDH1A1 350/4885SMN1; SMN2 4775/4885
US-20130296335-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS TNNI3, MYLK2, TNNT2 TSHR 4091/4885ALDH1A1 3849/4885SMN1; SMN2 1605/4885
US-10000502-B2 Substituted thiohydantoin derivatives as androgen receptor antagonists AR, SHBG, NR5A1 TSHR 70/4885ALDH1A1 350/4885SMN1; SMN2 4775/4885
US-20190343814-A1 PYRAZOLOPYRIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, PGK1 TSHR 4733/4885ALDH1A1 2205/4885SMN1; SMN2 3405/4885

“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.