SCHEMBL6443537

SCHEMBL6443537

O=C(CCl)N1CCC(Oc2ccc(F)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MLNR O43193 2/20 0.55
ADRB2 P07550 1/20 0.55
EPHX2 P34913 3/20 0.54
KMT2A Q03164 2/20 0.48
KCNH2 Q12809 1/20 0.47
MCHR1 Q99705 1/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
LIPE Q05469 1/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
PRKAA2 P54646 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
SCHEMBL4576825 0.87 EPHX2 (0.56) EPHX2KMT2AKCNH2MCHR1MEN1
SCHEMBL4577583 0.86 EPHX2 (0.52) EPHX2KMT2ALIPEMEN1POLB
SCHEMBL4578078 0.85 YAP1 (0.55) EPHX2KMT2ALIPEMEN1
SCHEMBL17422616 0.85 EPHX2 (0.56) EPHX2KMT2AKCNH2LIPE
Hydrochloric Acid SCHEMBL27826424 0.84 MLNR (0.52) MLNRADRB2EPHX2KMT2AKCNH2
SCHEMBL27900122 0.82 ADRB2 (0.53) MLNRADRB2EPHX2KCNH2MCHR1
SCHEMBL6443342 0.82 POLB (0.60) MLNREPHX2KMT2AMEN1POLB
SCHEMBL2773240 0.81 EPHX2 (0.53) MLNRADRB2EPHX2KMT2APLA2G1B
SCHEMBL4578888 0.81 ADRB2 (0.52) MLNRADRB2EPHX2KCNH2MCHR1
SCHEMBL20857043 0.81 YAP1 (0.50) EPHX2KMT2ALIPEPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534677-A1 PIPERIDINE DERIVATIVES AND THEIR USE AS SELECTIVE INHIBITORS OF MIP-1ALPHA BINDING TO ITS RECEPTOR CCR1 Pfizer Products Inc. (US) 2005-06-01 EP disclosed
US-20040063759-A1 Novel piperidine derivatives PFIZER INC. 2004-04-01 US disclosed
WO-2004009550-A1 PIPERIDINE DERIVATIVES AND THEIR USE AS SELECTIVE INHIBITORS OF MIP-1ALPHA BINDING TO ITS RECEPTOR CCR1 PFIZER PRODUCTS INC. (US) 2004-01-29 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-20040063759-A1 Novel piperidine derivatives CCR1, CCR3, CCR2 MLNR 760/4885ADRB2 686/4885EPHX2 3153/4885

“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.