SCHEMBL3143345

SCHEMBL3143345

CN(C(=O)O)C1(CNc2cnc(Cl)c(-c3ccncc3)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP46A1 Q9Y6A2 8/20 0.35
ADORA2B P29275 1/20 0.33
CCNT1 O60563 2/20 0.33
CDK9 P50750 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
CDK2 P24941 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
PIK3CA P42336 2/20 0.33
MTOR P42345 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
LATS1 O95835 1/20 0.32
ROCK2 O75116 1/20 0.32

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
SCHEMBL3146191 0.91 MAP4K4 (0.37) CCNT1CDK9CDK2
SCHEMBL3142555 0.90 ABL1 (0.39) CYP11B1CYP11B2
SCHEMBL3145780 0.89 MAP4K4 (0.34) CCNT1CDK9FNTAFNTBCDK2
SCHEMBL3151064 0.88 RAF1 (0.38) CYP46A1CYP11B1CYP11B2
SCHEMBL3152381 0.86 AR (0.38)
SCHEMBL3156239 0.80 ALDH1A1 (0.33) CYP11B1CYP11B2
SCHEMBL3147054 0.80 FFAR4 (0.38) CYP11B1CYP11B2
SCHEMBL3143340 0.79 ADORA2B (0.34) CYP46A1ADORA2BCCNT1CDK9CDK2
SCHEMBL3147370 0.77 ABL1 (0.36)
SCHEMBL3142559 0.77 PIK3CD (0.34) ADORA2BCCNT1CDK9CDK2CYP11B1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317698-A1 Polysubstituted Pyridinylaminoalkylene- and Pyridinyloxyalkylene-Cyclopropanamine Compounds, a Process for Their Preparation and Pharmaceutical Compositions Containing Them LES LABORATOIRES SERVIER (FR) 2010-12-16 US disclosed
EP-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 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-20100317698-A1 Polysubstituted Pyridinylaminoalkylene- and Pyridinyloxyalkylene-Cyclopropanamine Compounds, a Process for Their Preparation and Pharmaceutical Compositions Containing Them CHRNA6, CHRNE, CHRNG CYP46A1 2353/4885ADORA2B 78/4885CCNT1 1934/4885

“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.