SCHEMBL6760355

SCHEMBL6760355

O=C(COc1ccc(Br)cc1O)N1C2CCC1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.39
GRIN2B Q13224 4/20 0.39
EPHX2 P34913 1/20 0.38
MAPK1 P28482 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NAAA Q02083 1/20 0.38
RAB9A P51151 1/20 0.37
RECQL P46063 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
PKM P14618 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TP53 P04637 1/20 0.35

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
SCHEMBL6760353 1.00 GRIN1 (0.39) GRIN1GRIN2BEPHX2MAPK1MEN1
SCHEMBL6760359 0.88 MAPK1 (0.51) GRIN1GRIN2BEPHX2MAPK1MEN1
SCHEMBL6760357 0.88 MAPK1 (0.51) GRIN1GRIN2BEPHX2MAPK1MEN1
SCHEMBL6758352 0.88 TSHR (0.43) GRIN1GRIN2BEPHX2MEN1KMT2A
SCHEMBL6758359 0.88 TSHR (0.43) GRIN1GRIN2BEPHX2MEN1KMT2A
SCHEMBL6758160 0.87 OPRK1 (0.39) EPHX2MAPK1MEN1KMT2ANAAA
SCHEMBL6758164 0.87 OPRK1 (0.39) EPHX2MAPK1MEN1KMT2ANAAA
SCHEMBL6762776 0.87 MAPK1 (0.40) GRIN1GRIN2BEPHX2MAPK1MEN1
SCHEMBL6761310 0.87 CCR1 (0.42) GRIN1GRIN2BEPHX2MAPK1MEN1
SCHEMBL6762783 0.87 MAPK1 (0.40) GRIN1GRIN2BEPHX2MAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US claimed
US-20040063688-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 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-20040063688-A1 Novel piperidine derivatives CCR1, CCR3, CCR2 GRIN1 1153/4885GRIN2B 2149/4885EPHX2 3279/4885

“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.