SCHEMBL7161998

SCHEMBL7161998

O=Cc1cc(Br)c(OCCCc2ccccc2)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
THRA P10827 2/20 0.43
THRB P10828 2/20 0.43
IDO1 P14902 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPY1R P25929 1/20 0.42
NPY2R P49146 1/20 0.42
MAOA P21397 3/20 0.41
MAOB P27338 3/20 0.41
POLB P06746 1/20 0.41
FFAR1 O14842 1/20 0.40
RHEB Q15382 1/20 0.40
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
HPGD P15428 1/20 0.39
AKR1B10 O60218 1/20 0.39

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
SCHEMBL7164257 0.95 ALDH1A1 (0.48) LMNAALDH1A1MAPTTHRATHRB
SCHEMBL9218176 0.94 ALDH1A1 (0.47) LMNAALDH1A1MAPTTHRATHRB
SCHEMBL7163250 0.94 ALDH1A1 (0.47) LMNAALDH1A1MAPTTHRATHRB
SCHEMBL7168103 0.92 ALDH1A1 (0.50) LMNAALDH1A1MAPTTHRATHRB
SCHEMBL3955227 0.83 THRA (0.57) LMNAALDH1A1MAPTTHRATHRB
SCHEMBL14835642 0.79 ALOX5 (0.51) LMNAALDH1A1MAPTHPGD
SCHEMBL7161992 0.79 THRA (0.43) LMNATHRATHRBIDO1MEN1
SCHEMBL14195850 0.79 ALDH1A1 (0.55) LMNAALDH1A1MAPTTHRATHRB
SCHEMBL1981552 0.77 HPGD (0.52) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL2649971 0.75 ALDH1A1 (0.44) LMNAALDH1A1MAPTTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186998-A1 Methods for treatment of disorders of cardiac contractility JOHN HOPKINS UNIVERSITY 2003-10-02 US disclosed
US-6569862-B1 Adminstering xanthine oxidase inhibitor such as allopurinol JOHNS HOPKINS UNIVERSITY 2003-05-27 US disclosed
EP-1044002-A4 METHODS FOR TREATMENT OF DISORDERS OF CARDIAC CONTRACTILITY UNIV JOHNS HOPKINS (US) 2003-05-02 EP disclosed
US-6191136-B1 ADMINISTERING XANTHINE OXIDASE INHIBITOR JOHNS HOPKINS UNIVERSITY 2001-02-20 US disclosed
EP-1044002-A1 METHODS FOR TREATMENT OF DISORDERS OF CARDIAC CONTRACTILITY JOHNS HOPKINS UNIVERSITY (US) 2000-10-18 EP disclosed
WO-1999024038-A1 METHODS FOR TREATMENT OF DISORDERS OF CARDIAC CONTRACTILITY JOHNS HOPKINS UNIVERSITY (US) 1999-05-20 WO disclosed
EP-0269859-B2 Pyrazolotriazine compounds OTSUKA PHARMA CO LTD (JP) 1995-10-18 EP disclosed
US-4824834-A TREATING GOUT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-04-25 US disclosed
EP-0269859-A2 Pyrazolotriazine compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-06-08 EP 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-20030186998-A1 Methods for treatment of disorders of cardiac contractility TNNI3, TNNT2, RYR2 LMNA 1576/4885ALDH1A1 2260/4885MAPT 4157/4885

“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.