SCHEMBL2875360

SCHEMBL2875360

O=C(Cn1nc(Br)c(Br)c1Br)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ME2 P23368 1/20 0.55
ME1 P48163 1/20 0.55
ME3 Q16798 1/20 0.55
CCR1 P32246 2/20 0.54
MAPT P10636 2/20 0.54
POLB P06746 1/20 0.53
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 2/20 0.50
EIF4H Q15056 1/20 0.48
GFER P55789 1/20 0.48
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.47

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
SCHEMBL2874558 0.81 CCR1 (0.61) ME2ME1ME3CCR1MAPT
SCHEMBL2873980 0.81 CCR1 (0.64) CCR1MAPTPOLBALDH1A1GFER
SCHEMBL13066136 0.79 CCR1 (0.61) ME2ME1ME3CCR1MAPT
SCHEMBL2874438 0.78 GFER (0.49) CCR1MAPTPOLBKMT2AMEN1
SCHEMBL13024641 0.78 CCR1 (0.60) ME2ME1ME3CCR1MAPT
SCHEMBL2873051 0.78 CCR1 (0.77) CCR1
SCHEMBL2874783 0.76 CCR1 (0.58) ME2ME1ME3CCR1MAPT
SCHEMBL13682907 0.76 CCR1 (0.64) ME2ME1ME3CCR1MAPT
SCHEMBL13066545 0.76 GFER (0.49) CCR1MAPTPOLBKMT2AALDH1A1
SCHEMBL14027086 0.76 CCR1 (0.66) CCR1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 US disclosed
US-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 US disclosed
US-7842693-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2010-11-30 US disclosed
US-7842693-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2010-11-30 US disclosed
US-7842693-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2010-11-30 US disclosed
US-20100240618-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2010-09-23 US disclosed
US-20100240618-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2010-09-23 US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 US disclosed
US-20080261987-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2008-10-23 US disclosed
US-20080261987-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2008-10-23 US disclosed
US-20080261987-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2008-10-23 US disclosed
US-7157464-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2007-01-02 US disclosed
US-7157464-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2007-01-02 US disclosed
US-7157464-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2007-01-02 US disclosed
US-20060106218-A1 Substituted piperazines CHEMOCENTRYX, INC. (US) 2006-05-18 US disclosed
US-20050256130-A1 Substituted piperazines CHEMOCENTRYX, INC. (US) 2005-11-17 US disclosed
US-20040162282-A1 Substituted piperazines CHEMOCENTRYX, INC. 2004-08-19 US disclosed
US-20040082571-A1 Substituted piperazines CHEMOCENTRYX, INC. (US) 2004-04-29 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 (6 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-20080261987-A1 SUBSTITUTED PIPERAZINES CCR1, CCR3, CCRL2 ME2 4171/4885ME1 3290/4885ME3 4291/4885
US-20040082571-A1 Substituted piperazines CCR1, CCR3, CCRL2 ME2 4171/4885ME1 3290/4885ME3 4291/4885
US-20060106218-A1 Substituted piperazines CCR1, CCR3, CCRL2 ME2 4209/4885ME1 3024/4885ME3 4282/4885
US-20050256130-A1 Substituted piperazines CCR1, CCR3, CCRL2 ME2 4209/4885ME1 3024/4885ME3 4282/4885
US-20040162282-A1 Substituted piperazines CCR1, CCR3, CCRL2 ME2 4171/4885ME1 3290/4885ME3 4291/4885
US-20100240618-A1 SUBSTITUTED PIPERAZINES CCR1, CCR3, CCRL2 ME2 4209/4885ME1 3024/4885ME3 4282/4885

“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.