SCHEMBL3598740

SCHEMBL3598740

O=C(O)N1CCN(C2CCCN(C3CC3)C2)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.45
ALDH1A1 P00352 5/20 0.45
POLB P06746 2/20 0.45
L3MBTL3 Q96JM7 4/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CHRM1 P11229 3/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM3 P20309 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL3598735 1.00 KDM4E (0.45) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL31664986 0.87 CHRM1 (0.46) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL65252 0.85 POLB (0.52) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL3768409 0.85 POLB (0.56) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL65329 0.84 HRH3 (0.47) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL1507253 0.83 HRH3 (0.52) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL3601428 0.83 POLB (0.59) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL18619500 0.83 POLB (0.59) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL2908394 0.81 CHRM1 (0.51) KDM4EALDH1A1POLBL3MBTL3L3MBTL1
SCHEMBL21482671 0.81 POLB (0.54) KDM4EALDH1A1POLBL3MBTL3L3MBTL1

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 6 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
CN-101365698-A 2-urea-4-phenylthiazole derivatives, their preparation and their therapeutic use SANOFI AVENTIS (FR) 2009-02-11 CN 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
CN-101365698-A 2-urea-4-phenylthiazole derivatives, their preparation and their therapeutic use SANOFI AVENTIS (FR) 2009-02-11 CN 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 KDM4E 114/4885ALDH1A1 838/4885POLB 4267/4885

“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.