SCHEMBL3592203

SCHEMBL3592203

O=C(O)N1CCCN(C2CCOCC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.58
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
L3MBTL3 Q96JM7 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL3590803 0.93 HRH3 (0.55) HRH3
SCHEMBL1507253 0.85 HRH3 (0.52) HRH3KDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL21482671 0.84 POLB (0.54) HRH3KDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL29086901 0.82 HRH3 (0.45) HRH3
SCHEMBL4471423 0.79 L3MBTL3 (0.57) HRH3ALDH1A1L3MBTL3L3MBTL1
SCHEMBL65252 0.79 POLB (0.52) HRH3KDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL4334091 0.79 L3MBTL3 (0.58) L3MBTL3L3MBTL1MEN1KMT2A
SCHEMBL3768409 0.79 POLB (0.56) HRH3KDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL65329 0.79 HRH3 (0.47) HRH3KDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL6464543 0.79 HRH3 (0.46) HRH3KDM4EALDH1A1L3MBTL3L3MBTL1

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-7825112-B2 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-11-02 US claimed
US-20090018117-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-01-15 US claimed
US-7825112-B2 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-11-02 US disclosed
US-20090018117-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-01-15 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-20090018117-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF PKD2, QPCT, CCNT2 HRH3 601/4885KDM4E 114/4885ALDH1A1 838/4885

“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.