SCHEMBL4509840

SCHEMBL4509840

Cc1c(Cl)c(-c2ncco2)nn1CC(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 10/20 0.44
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.36
CYP46A1 Q9Y6A2 2/20 0.35
OPRD1 P41143 1/20 0.35
TP53 P04637 1/20 0.35
SPR P35270 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C8 P10632 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
FPR2 P25090 1/20 0.35
PROKR1 Q8TCW9 1/20 0.35
KCNH2 Q12809 1/20 0.35
UTS2R Q9UKP6 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
SCHEMBL13763191 0.86 CCR1 (0.46) CCR1KDM4ELMNASMN1; SMN2L3MBTL1
SCHEMBL14495077 0.80 CCR1 (0.42) CCR1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL4511596 0.79 CCR1 (0.69) CCR1CYP2C19KCNH2
SCHEMBL5311041 0.79 FPR2 (0.35) FPR2PROKR1KCNH2UTS2R
SCHEMBL4455328 0.77 CCR1 (0.40) CCR1KDM4EL3MBTL1
SCHEMBL4449977 0.76 CCR1 (0.49) CCR1CYP2C19KCNH2
SCHEMBL2984091 0.72 ALDH1A1 (0.41) LMNAL3MBTL1
SCHEMBL13761091 0.72 CCR1 (0.49) CCR1CYP2C19KCNH2
SCHEMBL4517149 0.72 CCR1 (0.59) CCR1CYP2C19KCNH2
SCHEMBL3464645 0.71 CCR1 (0.70) CCR1CYP2C19KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576106-B2 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2009-08-18 US claimed
US-7576106-B2 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2009-08-18 US disclosed
US-7576106-B2 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2009-08-18 US disclosed
US-7576106-B2 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2009-08-18 US disclosed
WO-2007073432-A2 PIPERIDINE DERIVATIVES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-06-28 WO disclosed
WO-2007073432-A2 PIPERIDINE DERIVATIVES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-06-28 WO disclosed
US-20070093467-A1 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2007-04-26 US disclosed
US-20070093467-A1 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2007-04-26 US disclosed
US-20070093467-A1 Piperidine derivatives and methods of use CHEMOCENTRYX, INC. (US) 2007-04-26 US disclosed
WO-2007044885-A2 PIPERIDINE DERIVATIVES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-04-19 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-20070093467-A1 Piperidine derivatives and methods of use CCR1, CCR3, CCR4 CCR1 1/4885KDM4E 4134/4885LMNA 3293/4885

“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.