SCHEMBL5843310

SCHEMBL5843310

CCN(c1ccccc1)c1ccc(N)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.64
TDP1 Q9NUW8 4/20 0.64
ALDH1A1 P00352 4/20 0.64
MAPT P10636 3/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
KDM4E B2RXH2 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP2D6 P10635 1/20 0.64
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
TSHR P16473 4/20 0.56
MAPK1 P28482 2/20 0.56
PSMD14 O00487 1/20 0.56
RECQL P46063 1/20 0.56
GFER P55789 1/20 0.56
NR3C2 P08235 1/20 0.51
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
DHFR P00374 2/20 0.44
CRHBP P24387 1/20 0.43

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
SCHEMBL7149333 0.89 NR3C2 (0.60) CYP3A4TDP1ALDH1A1MAPTL3MBTL1
SCHEMBL409370 0.86 NR3C2 (0.57) TDP1ALDH1A1MAPTL3MBTL1KDM4E
SCHEMBL6567347 0.86 NR3C2 (0.57) TDP1ALDH1A1MAPTL3MBTL1KDM4E
SCHEMBL16408145 0.84 NR3C2 (0.56) CYP3A4TDP1ALDH1A1MAPTL3MBTL1
Iodide SCHEMBL31634397 0.84 NR3C2 (0.55) TDP1ALDH1A1MAPTL3MBTL1KDM4E
Hydrochloric Acid SCHEMBL27464725 0.84 NR3C2 (0.55) ALDH1A1MAPTL3MBTL1KDM4ECYP1A2
Bromide SCHEMBL6737911 0.84 NR3C2 (0.55) TDP1ALDH1A1MAPTL3MBTL1KDM4E
SCHEMBL7062571 0.83 CYP3A4 (0.59) CYP3A4TDP1ALDH1A1MAPTL3MBTL1
SCHEMBL18979892 0.82 CYP3A4 (0.62) CYP3A4TDP1ALDH1A1MAPTL3MBTL1
SCHEMBL3368539 0.82 NR3C2 (0.55) CYP3A4TDP1ALDH1A1MAPTL3MBTL1

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
EP-0028999-B1 PROCESS FOR THE PREPARATION OF ANTIOXIDANT AMIDES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-03-23 EP claimed
EP-2923691-A1 Method of suppressing background rise in color reagent solution, color reagent solution, reagent kit, and measuring apparatus ARKRAY, Inc. (JP) 2015-09-30 EP disclosed
CN-100534990-C Pyrrolidone carboxamides ACTELION PHARMACEUTICALS LTD (CH) 2009-09-02 CN disclosed
US-7067549-B2 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2006-06-27 US disclosed
US-20050192292-A1 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2005-09-01 US disclosed
CN-1610678-A Pyrrolidone carboxamides ACTELION PHARMACEUTICALS LTD (CH) 2005-04-27 CN disclosed
EP-1463724-A1 PYRROLIDONE CARBOXAMIDES Actelion Pharmaceuticals Ltd. (CH) 2004-10-06 EP disclosed
WO-2003059905-A1 PYRROLIDONE CARBOXAMIDES ACTELION PHARMACEUTICALS LTD (CH) 2003-07-24 WO disclosed
EP-0581589-A2 Phthalide compounds, and recording materials using the compounds YAMAMOTO CHEMICALS, INC. (JP) 1994-02-02 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 (1 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-20050192292-A1 Pyrrolidone carboxamides NPY1R, NPY5R, NPY2R CYP3A4 1975/4885TDP1 3359/4885ALDH1A1 3034/4885

“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.