SCHEMBL6761307

SCHEMBL6761307

O=C(O)Cc1cc(Br)ccc1OCC(=O)N1[C@@H]2CC[C@H]1CC(Oc1ccc(F)cc1)C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.42
MAPK1 P28482 2/20 0.40
HSD17B10 Q99714 1/20 0.40
PTGDR2 Q9Y5Y4 5/20 0.40
PTGDR Q13258 1/20 0.36
PKM P14618 1/20 0.36
EPHX2 P34913 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NAAA Q02083 1/20 0.36
RAB9A P51151 1/20 0.35
PTGER1 P34995 1/20 0.35
AKR1A1 P14550 1/20 0.35
AKR1B1 P15121 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35
KCNH2 Q12809 1/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL6761310 1.00 CCR1 (0.42) CCR1MAPK1HSD17B10PTGDR2PTGDR
SCHEMBL6762776 0.93 MAPK1 (0.40) CCR1MAPK1HSD17B10PTGDR2PKM
SCHEMBL6762783 0.93 MAPK1 (0.40) CCR1MAPK1HSD17B10PTGDR2PKM
SCHEMBL6760359 0.91 MAPK1 (0.51) CCR1MAPK1HSD17B10PTGDR2PKM
SCHEMBL6760357 0.91 MAPK1 (0.51) CCR1MAPK1HSD17B10PTGDR2PKM
SCHEMBL6155917 0.89 CCR1 (0.54) CCR1PTGDR2PTGDREPHX2
SCHEMBL6758127 0.89 CCR1 (0.54) CCR1PTGDR2PTGDREPHX2
SCHEMBL6155923 0.89 CCR1 (0.54) CCR1PTGDR2PTGDREPHX2
SCHEMBL6760355 0.87 GRIN1 (0.39) MAPK1HSD17B10PKMEPHX2MEN1
SCHEMBL6760353 0.87 GRIN1 (0.39) MAPK1HSD17B10PKMEPHX2MEN1

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 CCR1 1/4885MAPK1 438/4885HSD17B10 4377/4885

“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.