SCHEMBL2953786

SCHEMBL2953786

CC(C)(C)OC(=O)N1CCN(C2CCCN(Cc3ccccc3)C2)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
GPR119 Q8TDV5 1/20 0.48
STS P08842 1/20 0.47
MAOB P27338 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 1/20 0.47
ACHE P22303 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 2/20 0.47
THRB P10828 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL13443092 0.93 ACHE (0.54) KMT2AGPR119STSALDH1A1KDM4E
SCHEMBL3570582 0.86 ACHE (0.61) KMT2AGPR119STSALDH1A1KDM4E
SCHEMBL642727 0.84 JAK2 (0.54) GPR119STSALDH1A1KDM4EACHE
SCHEMBL642728 0.84 JAK2 (0.54) GPR119STSALDH1A1KDM4EACHE
SCHEMBL3779080 0.84 CHRM4 (0.56) GPR119STSALDH1A1KDM4EACHE
SCHEMBL3594265 0.84 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL3966170 0.83 CHRM4 (0.55) GPR119STSALDH1A1KDM4EACHE
SCHEMBL519496 0.83 SMN1; SMN2 (0.50) KMT2AMEN1GPR119STSALDH1A1
SCHEMBL643291 0.83 ALDH1A1 (0.48) KMT2AMEN1GPR119STSALDH1A1
SCHEMBL13206336 0.83 GPR119 (0.48) GPR119STSALDH1A1KDM4EACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767681-B2 2-Carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-08-03 US disclosed
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-08-02 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-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof UGT2B7, PKD2, CYP2C19 BCHE 184/4885KMT2A 1446/4885MEN1 990/4885

“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.