SCHEMBL4564428

SCHEMBL4564428

CO/N=C(/C(=O)OC)c1ccccc1COc1ccc(C)cc1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.71
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
OPRL1 P41146 1/20 0.43
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 2/20 0.42
MAOB P27338 1/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL6571845 0.91 HIF1A (0.80) HIF1AALDH1A1HPGDOPRL1HTT
SCHEMBL9025823 0.91 HIF1A (0.80) HIF1AALDH1A1HPGDOPRL1HTT
SCHEMBL5022336 0.89 HIF1A (0.57) HIF1AMEN1KMT2AALDH1A1HPGD
SCHEMBL8624119 0.89 HIF1A (0.57) HIF1AMEN1KMT2AALDH1A1HPGD
SCHEMBL9450116 0.88 HIF1A (0.69) HIF1AALDH1A1MAOBHTT
SCHEMBL30746040 0.88 HIF1A (0.69) HIF1AALDH1A1MAOBHTT
SCHEMBL8096251 0.88 HIF1A (0.56) HIF1AMEN1KMT2AALDH1A1HPGD
SCHEMBL8096246 0.88 HIF1A (0.56) HIF1AMEN1KMT2AALDH1A1HPGD
SCHEMBL8369944 0.88 HIF1A (0.56) HIF1AMEN1KMT2AALDH1A1HPGD
SCHEMBL8399101 0.86 HIF1A (0.54) HIF1AMEN1KMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 US disclosed
EP-1244357-B1 PEST CONTROL AGENT/PF 1022-221 BAYER CROPSCIENCE AG (DE) 2005-03-02 EP disclosed
EP-1080072-B1 2-(2-CHLOROPHENYL)-3,4-DIHYDRO-2H-PYRROL DERIVATIVES BAYER CROPSCIENCE AG (DE) 2004-08-04 EP disclosed
EP-0942904-B1 3-THIOCARBAMOYLPYRAZOLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2004-06-23 EP disclosed
EP-0970059-B1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER CROPSCIENCE AG (DE) 2003-08-20 EP disclosed
EP-0944608-B1 4-CYCLOHEXYLPHENYL-OXAZOLINES AND THEIR USE FOR CONTROLLING ANIMAL PESTS BAYER CROPSCIENCE AG (DE) 2003-04-16 EP disclosed
EP-1285941-A1 Use of alkoxylated phenols Bayer Aktiengesellschaft (DE) 2003-02-26 EP disclosed
EP-1139739-B1 AGROCHEMICAL FORMULATIONS BAYER AG (DE) 2002-09-11 EP disclosed
EP-0773720-B1 FUNGICIDAL COMPOSITION INCLUDING A 2-IMIDAZOLINE-5-ONE AVENTIS CROPSCIENCE SA (FR) 2000-10-18 EP disclosed
US-5556880-A N,N-DIALKYL-2-(3,4-DIMETHOXYPHENYL-4-(TRIFLUOROMETHYL) DERIVATIVES OF BENZAMIDE RHONE-POULENC AGROCIMIE (FR) 1996-09-17 US disclosed
WO-1996019111-A1 USE OF LAURIC ACID ESTERS AS POTENCY INCREASING AGENTS FOR ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 1996-06-27 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-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides CBR3, CBR1, SNU13 HIF1A 2204/4885MEN1 2667/4885KMT2A 2448/4885

“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.