SCHEMBL14768426

SCHEMBL14768426

COC(=O)Cc1ccc(O)c(-c2cc(CC(=O)OC)ccc2O)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.70
ALDH1A1 P00352 3/20 0.70
GFER P55789 1/20 0.70
HSP90AB1 P08238 1/20 0.56
CYP4F2 P78329 1/20 0.53
CYP4A11 Q02928 1/20 0.53
TSHR P16473 3/20 0.49
NFKB1 P19838 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
HPGD P15428 4/20 0.48
MAPT P10636 3/20 0.48
YWHAG P61981 1/20 0.47
PDK2 Q15119 1/20 0.47
SLC7A5 Q01650 1/20 0.45
KDM4E B2RXH2 2/20 0.44
RGS12 O14924 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 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
SCHEMBL17124778 0.91 GAA (0.59) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL9202609 0.87 ALDH1A1 (0.59) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL3668882 0.87 GAA (0.72) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL29446278 0.87 GAA (0.72) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL21076155 0.87 ALDH1A1 (0.55) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL18269502 0.85 ALDH1A1 (0.54) GAAALDH1A1GFERHSP90AB1CYP4F2
Methyl Alcohol SCHEMBL27946196 0.85 GAA (0.70) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL8145260 0.84 ALDH1A1 (0.68) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL2127019 0.84 GAA (0.68) GAAALDH1A1GFERHSP90AB1CYP4F2
SCHEMBL30096935 0.84 GAA (0.68) GAAALDH1A1GFERHSP90AB1CYP4F2

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
US-9499471-B2 Biphenyl compounds for use in treating malaria and other parasitic disorders MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2016-11-22 US disclosed
US-9499471-B2 Biphenyl compounds for use in treating malaria and other parasitic disorders MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2016-11-22 US disclosed
US-20150274637-A1 BIPHENYL COMPOUNDS FOR USE IN TREATING MALARIA AND OTHER PARASITIC DISORDERS GOTTFRIED WILHELM LEIBNIZ UNIVERSITAET HANNOVER (DE) 2015-10-01 US disclosed
US-20150274637-A1 BIPHENYL COMPOUNDS FOR USE IN TREATING MALARIA AND OTHER PARASITIC DISORDERS GOTTFRIED WILHELM LEIBNIZ UNIVERSITAET HANNOVER (DE) 2015-10-01 US disclosed
WO-2013034756-A1 BIPHENYL COMPOUNDS FOR USE IN TREATING MALARIA AND OTHER PARASITIC DISORDERS MEDIZINISCHE HOCHSCHULE HANNOVER (DE) 2013-03-14 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-20150274637-A1 BIPHENYL COMPOUNDS FOR USE IN TREATING MALARIA AND OTHER PARASITIC DISORDERS CYP1B1, CYP1A2, CYP1A1 GAA 851/4885ALDH1A1 75/4885GFER 1256/4885

“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.