SCHEMBL3928617

SCHEMBL3928617

CC(C)(C)c1ccc(OCC(=O)NCc2ccc3[nH]c(=O)[nH]c3c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
KDM4E B2RXH2 4/20 0.59
MAPT P10636 4/20 0.59
GAA P10253 4/20 0.59
KMT2A Q03164 4/20 0.59
HPGD P15428 3/20 0.59
NPSR1 Q6W5P4 3/20 0.59
MEN1 O00255 3/20 0.59
G6PD P11413 1/20 0.59
BLM P54132 1/20 0.59
MAPK1 P28482 2/20 0.53
EPHX2 P34913 3/20 0.52
NR1H4 Q96RI1 3/20 0.52
POLB P06746 3/20 0.47
HSD17B10 Q99714 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALOX15 P16050 1/20 0.47
CASP1 P29466 1/20 0.47
CYP2C19 P33261 1/20 0.46
ERCC1 P07992 1/20 0.46

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
SCHEMBL5972503 0.86 ESRRB (0.48) EPHX2NR1H4
SCHEMBL3926951 0.84 MAPK1 (0.48) ALDH1A1KDM4EMAPTGAAKMT2A
SCHEMBL3918684 0.84 KDM4E (0.52) ALDH1A1KDM4EMAPTGAAKMT2A
SCHEMBL3931516 0.84 KDM4E (0.52) ALDH1A1KDM4EMAPTGAAKMT2A
SCHEMBL3929061 0.84 ALDH1A1 (0.51) ALDH1A1KDM4EMAPTGAAKMT2A
SCHEMBL5972423 0.83 TRPV1 (0.51) ALDH1A1KDM4EMAPTGAAKMT2A
SCHEMBL6421064 0.82 NR1H4 (0.59) KMT2AMEN1EPHX2NR1H4CYP2C19
SCHEMBL3921256 0.81 MAPK1 (0.50) ALDH1A1GAAKMT2AMEN1MAPK1
SCHEMBL5177709 0.78 GAA (0.74) ALDH1A1KDM4EGAAKMT2AHPGD
SCHEMBL14099146 0.78 EPHX2 (0.63) ALDH1A1GAAKMT2AHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514457-B2 Substituted aryloxymethyl bicyclicmethyl acetamide compounds PFIZER INC. (US) 2009-04-07 US claimed
US-20060270682-A1 Substituted Aryloxymethyl Bicyclicmethyl Acetamide Compounds PFIZER, INC. 2006-11-30 US claimed
US-7514457-B2 Substituted aryloxymethyl bicyclicmethyl acetamide compounds PFIZER INC. (US) 2009-04-07 US disclosed
US-7514457-B2 Substituted aryloxymethyl bicyclicmethyl acetamide compounds PFIZER INC. (US) 2009-04-07 US disclosed
US-7514457-B2 Substituted aryloxymethyl bicyclicmethyl acetamide compounds PFIZER INC. (US) 2009-04-07 US disclosed
US-20060270682-A1 Substituted Aryloxymethyl Bicyclicmethyl Acetamide Compounds PFIZER, INC. 2006-11-30 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-20060270682-A1 Substituted Aryloxymethyl Bicyclicmethyl Acetamide Compounds NR0B1, NR0B2, NR2C2 ALDH1A1 1515/4885KDM4E 3885/4885MAPT 4670/4885

“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.