SCHEMBL13041010

SCHEMBL13041010

CN1CCN(C=Cc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.58
POLB P06746 1/20 0.54
HRH4 Q9H3N8 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
HRH1 P35367 3/20 0.44
HTR6 P50406 2/20 0.44
HPGD P15428 2/20 0.42
CHRM1 P11229 2/20 0.42
MAPT P10636 2/20 0.42
MC4R P32245 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CYP2D6 P10635 1/20 0.42
CHRM3 P20309 1/20 0.42
DRD1 P21728 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
SCHEMBL31547211 1.00 SIGMAR1 (0.58) SIGMAR1POLBHRH4MEN1ALDH1A1
SCHEMBL28546334 0.89 MAOB (0.50) SIGMAR1POLBMEN1ALDH1A1KMT2A
SCHEMBL5572239 0.89 MAOB (0.50) SIGMAR1POLBMEN1ALDH1A1KMT2A
SCHEMBL7050058 0.84 SIGMAR1 (0.49) SIGMAR1POLBHRH4MAPTMC4R
SCHEMBL6516804 0.80 KMT2A (0.48) POLBMEN1ALDH1A1KMT2AMAPT
SCHEMBL6516806 0.80 KMT2A (0.48) POLBMEN1ALDH1A1KMT2AMAPT
SCHEMBL27262953 0.79 ALDH1A1 (0.45) SIGMAR1POLBMEN1ALDH1A1KMT2A
SCHEMBL5311679 0.78 HSP90AA1 (0.49) MEN1ALDH1A1KMT2AHPGDMAPT
SCHEMBL1854513 0.78 SIGMAR1 (0.52) SIGMAR1POLBHRH4MEN1ALDH1A1
SCHEMBL31547213 0.78 HSP90AA1 (0.49) MEN1ALDH1A1KMT2AHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7829568-B2 Substituted 5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylamine compounds and their use for producing drugs GRUENENTHAL GMBH (DE) 2010-11-09 US disclosed
US-7829568-B2 Substituted 5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylamine compounds and their use for producing drugs GRUENENTHAL GMBH (DE) 2010-11-09 US disclosed
US-20080300256-A1 Substituted 5,6,7,8-Tetrahydroimidazo[1,2-a]pyridin-2-ylamine Compounds and Their Use for Producing Drugs GRUENENTHAL GMBH (DE) 2008-12-04 US disclosed
US-20080300256-A1 Substituted 5,6,7,8-Tetrahydroimidazo[1,2-a]pyridin-2-ylamine Compounds and Their Use for Producing Drugs GRUENENTHAL GMBH (DE) 2008-12-04 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 (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-20080300256-A1 Substituted 5,6,7,8-Tetrahydroimidazo[1,2-a]pyridin-2-ylamine Compounds and Their Use for Producing Drugs CYP3A7, CYP3A5, CYP2D6 SIGMAR1 891/4885POLB 3033/4885HRH4 271/4885

“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.