SCHEMBL4547676

SCHEMBL4547676

Fc1ccc(OCc2ccccc2Cl)c(C[PH](c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
FABP4 P15090 2/20 0.42
FABP5 Q01469 2/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
MCL1 Q07820 1/20 0.42
SLC6A4 P31645 1/20 0.42
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
PTGER1 P34995 1/20 0.40
TP53 P04637 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
SCHEMBL12384418 0.88 FABP4 (0.49) MAPTFABP4FABP5GAATHRB
SCHEMBL12384365 0.87 MCL1 (0.48) MAPTGAATHRBMCL1SLC6A4
SCHEMBL12384374 0.84 L3MBTL1 (0.47) MAPTGAAFFAR1FFAR4PTGER1
SCHEMBL12384351 0.82 SLC6A4 (0.44) SLC6A4FFAR1FFAR4LMNAPTGDR2
SCHEMBL2292221 0.80 MAPT (0.50) MAPTFABP4FABP5GAATHRB
SCHEMBL14784730 0.80 MAPT (0.47) MAPTFABP4FABP5GAATHRB
SCHEMBL12384370 0.77 PTPN1 (0.43) PTGER1LMNA
Bromide SCHEMBL2293792 0.76 FABP4 (0.41) MAPTFABP4FABP5GAATHRB
SCHEMBL12384381 0.76 MAOB (0.42) MAPTSMN1; SMN2RAB9AFFAR1FFAR4
SCHEMBL4547677 0.74 PPARD (0.44) SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940811-B1 HETEROCYCLIC COMPOUNDS WITH CARBOXYL ISOSTERE GROUPS AND THEIR USE FOR THE TREATMENT OF CARDIOVASCULAR DISEASES BAYER IP GMBH (DE) 2014-02-26 EP disclosed
US-8173704-B2 Difluorophenol derivatives and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-05-08 US disclosed
US-7998988-B2 Biphenyl compounds useful in the treatment or prevention of cardiovascular disorders BAYER SCHERING PHARMA AKTIENGELLSCHAFT (DE) 2011-08-16 US disclosed
US-20090291993-A1 Difluorophenol Derivatives and Their Use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-11-26 US disclosed
US-20090227640-A1 Heterocyclic compounds with carboxyl isostere groups and their use for the treatment of cardiovascular diseases BAYER HEALTHCARE AG (DE) 2009-09-10 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 (2 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-20090227640-A1 Heterocyclic compounds with carboxyl isostere groups and their use for the treatment of cardiovascular diseases TNNI3, PC, TNNT2 MAPT 4498/4885FABP4 849/4885FABP5 2275/4885
US-20090291993-A1 Difluorophenol Derivatives and Their Use TPMT, FABP3, DPP4 MAPT 3669/4885FABP4 282/4885FABP5 173/4885

“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.