SCHEMBL5050751

SCHEMBL5050751

COCCOc1ccc(C(C)=O)cc1OCCOC

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MAOB P27338 2/20 0.51
MEN1 O00255 2/20 0.50
POLB P06746 1/20 0.49
CASP6 P55212 1/20 0.49
CREBBP Q92793 1/20 0.49
KDM4E B2RXH2 2/20 0.48
HTT P42858 1/20 0.48
TP53 P04637 1/20 0.48
SMPD1 P17405 3/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL6096092 0.93 KMT2A (0.63) KMT2AMAOBMEN1ALDH1A1TSHR
SCHEMBL4775181 0.93 KMT2A (0.56) KMT2AMAOBMEN1TP53SMPD1
SCHEMBL10034776 0.88 KMT2A (0.47) KMT2AMAOBMEN1CREBBPKDM4E
SCHEMBL1436418 0.86 POLB (0.64) POLBCASP6KDM4EHTTSMPD1
SCHEMBL13461243 0.86 KMT2A (0.56) KMT2AMAOBMEN1CREBBPSMPD1
SCHEMBL88815 0.85 KMT2A (0.62) KMT2AMAOBMEN1TP53SMPD1
SCHEMBL10034779 0.85 SLC6A4 (0.45) KMT2AMAOBMEN1POLBCREBBP
SCHEMBL20463365 0.85 HTT (0.49) KMT2AMAOBMEN1CREBBPKDM4E
SCHEMBL1055820 0.85 MAPT (0.54) KMT2APOLBCASP6KDM4EHTT
SCHEMBL9662476 0.84 SMN1; SMN2 (0.59) KMT2AMAOBMEN1POLBCASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008035209-A2 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2008-03-27 WO disclosed
US-20080004273-A1 Inhibitors of protein tyrosine kinase activity METHYLGENE, INC. (CA) 2008-01-03 US disclosed
US-20080004273-A1 Inhibitors of protein tyrosine kinase activity METHYLGENE, INC. (CA) 2008-01-03 US disclosed
US-20080004273-A1 Inhibitors of protein tyrosine kinase activity METHYLGENE, INC. (CA) 2008-01-03 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 (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-20080004273-A1 Inhibitors of protein tyrosine kinase activity HGF, ERBB2, MET KMT2A 2353/4885MAOB 1834/4885MEN1 3231/4885

“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.