SCHEMBL2159533

SCHEMBL2159533

CC(C)C(NC(=O)C1CCCC1)C(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 19/20 0.69
NR1I2 O75469 2/20 0.55
LMNA P02545 1/20 0.55
TSHR P16473 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL2159527 1.00 CCR1 (0.69) CCR1NR1I2LMNATSHRKMT2A
SCHEMBL2159586 0.88 CCR1 (0.74) CCR1NR1I2KMT2A
SCHEMBL2159581 0.88 CCR1 (0.74) CCR1NR1I2KMT2A
SCHEMBL2159153 0.85 CCR1 (0.78) CCR1NR1I2
SCHEMBL2159148 0.85 CCR1 (0.78) CCR1NR1I2
SCHEMBL10292006 0.84 CCR1 (0.73) CCR1NR1I2
SCHEMBL2160692 0.82 CCR1 (1.00) CCR1NR1I2
SCHEMBL2160698 0.82 CCR1 (1.00) CCR1NR1I2
SCHEMBL10292298 0.82 CCR1 (0.82) CCR1NR1I2
SCHEMBL10292241 0.81 CCR1 (0.78) CCR1NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7985861-B2 Piperidinyl derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2011-07-26 US disclosed
US-20090298833-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2009-12-03 US disclosed
EP-2049486-A2 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2009-04-22 EP disclosed
WO-2007092681-A2 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2007-08-16 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-20090298833-A1 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR1, CCR2, CCR3 CCR1 1/4885NR1I2 101/4885LMNA 4849/4885

“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.