SCHEMBL4014891

SCHEMBL4014891

Cc1c(Cl)c(C(F)(F)F)nn1C(C=O)N1CCN(c2ncccn2)CC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 13/20 0.37
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.33
OGA O60502 1/20 0.33

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
SCHEMBL4016957 0.88 KDM4E (0.44) CCR1HSD17B10MEN1KMT2AKDM4E
SCHEMBL4019904 0.85 CCR1 (0.53) CCR1LMNA
SCHEMBL4019925 0.83 CCR1 (0.40) CCR1LMNA
SCHEMBL4018625 0.83 CCR1 (0.53) CCR1MEN1KMT2A
SCHEMBL4309602 0.83 CCR1 (0.39) CCR1
SCHEMBL4018084 0.82 LMNA (0.42) CCR1HSD17B10MEN1KMT2AKDM4E
SCHEMBL4022376 0.82 CCR1 (0.54) CCR1MEN1KMT2A
SCHEMBL4016533 0.81 CCR1 (0.39) CCR1MEN1KMT2ALMNA
SCHEMBL4014637 0.81 CCR1 (0.41) CCR1
SCHEMBL4013644 0.81 CCR1 (0.48) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1691810-A4 SUBSTITUTED PIPERAZINES CHEMOCENTRYX INC (US) 2009-07-01 EP disclosed
EP-1691810-A1 SUBSTITUTED PIPERAZINES ChemoCentryx Inc (US) 2006-08-23 EP disclosed
WO-2005056015-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2005-06-23 WO disclosed