SCHEMBL7532012

SCHEMBL7532012

CC(Br)C(=O)c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 3/20 0.51
CES2 O00748 2/20 0.44
GSK3B P49841 1/20 0.44
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
LMNA P02545 2/20 0.41
CFTR P13569 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
SORT1 Q99523 1/20 0.40
PDK2 Q15119 1/20 0.40
USP2 O75604 1/20 0.40
CYP2C19 P33261 1/20 0.40
AVPR2 P30518 1/20 0.40
GPR27 Q9NS67 1/20 0.40
HSD11B1 P28845 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL21725666 0.87 PDE2A (0.54) PDE2ACES2KDM4EHPGDALDH1A1
SCHEMBL14054398 0.84 GSK3B (0.50) PDE2ACES2GSK3BKDM4EHPGD
SCHEMBL311471 0.79 PDE2A (0.45) PDE2ACES2GSK3BKDM4EHPGD
SCHEMBL6495907 0.78 PDE2A (0.50) PDE2ACES2KDM4EHPGDALDH1A1
SCHEMBL30482175 0.78 PDE2A (0.50) PDE2ACES2KDM4EHPGDALDH1A1
SCHEMBL1922201 0.78 SMN1; SMN2 (0.55) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL8393015 0.77 HPGD (0.45) HPGDALDH1A1MAPTSMN1; SMN2
SCHEMBL1922910 0.77 MAPK1 (0.46) HPGDALDH1A1MAPT
SCHEMBL1818435 0.76 KDM4E (0.62) PDE2ACES2KDM4EHPGDALDH1A1
SCHEMBL1455625 0.76 CES2 (0.52) PDE2ACES2KDM4EHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020137740-A1 Aminothiazole derivatives, process for preparing them and pharmaceutical compositions containing them FONTAINE EVELYNE (FR) 2002-09-26 US disclosed
EP-0934290-B1 AMINOTHIAZOLE DERIVATIVES, METHOD OF PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI SYNTHELABO (FR) 2002-04-17 EP disclosed
US-6344470-B1 Aminothiazole derivatives, method of preparation and pharmaceutical compositions containing same SANOFI-SYNTHELABO (FR) 2002-02-05 US disclosed
EP-0934290-A1 AMINOTHIAZOLE DERIVATIVES, METHOD OF PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI (FR) 1999-08-11 EP disclosed
US-5880135-A ANTAGONIST ACTIVITY WITH RESPECT TO CORTICOTROPIN RELEASING HORMONE SANOFI (FR) 1999-03-09 US disclosed
WO-1998015543-A1 AMINOTHIAZOLE DERIVATIVES, METHOD OF PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI (FR) 1998-04-16 WO disclosed
EP-0833822-A1 4-PHENYLAMINOTHIAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1998-04-08 EP disclosed
WO-1997000868-A1 4-PHENYLAMINOTHIAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1997-01-09 WO 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-20020137740-A1 Aminothiazole derivatives, process for preparing them and pharmaceutical compositions containing them CRHR1, ADRA1D, ADRB1 PDE2A 1565/4885CES2 2531/4885GSK3B 3884/4885

“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.