SCHEMBL6659913

SCHEMBL6659913

c1ccc(CN2CCN(CCCN3CCN(Cc4ccccc4)CCN(Cc4ccccc4)CC3)CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.79
SIGMAR1 Q99720 3/20 0.78
MC4R P32245 1/20 0.70
KDM1A O60341 1/20 0.66
DRD4 P21917 1/20 0.62
LMNA P02545 1/20 0.62
POLB P06746 1/20 0.62
KDM4E B2RXH2 1/20 0.60
ALDH1A1 P00352 1/20 0.60
KMT2A Q03164 1/20 0.60

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
Hydrochloric Acid SCHEMBL10502885 0.98 CCR3 (0.76) CCR3SIGMAR1MC4RKDM1ADRD4
SCHEMBL6657455 0.96 CCR3 (0.85) CCR3SIGMAR1MC4RKDM1ADRD4
SCHEMBL6657649 0.94 CCR3 (0.82) CCR3SIGMAR1MC4RDRD4LMNA
SCHEMBL6659339 0.91 SIGMAR1 (0.86) CCR3SIGMAR1MC4RDRD4LMNA
SCHEMBL11801794 0.90 CCR3 (0.89) CCR3SIGMAR1KDM4EALDH1A1KMT2A
SCHEMBL6323999 0.90 CCR3 (0.71) CCR3SIGMAR1MC4RKDM1ADRD4
SCHEMBL8188324 0.89 SIGMAR1 (1.00) CCR3SIGMAR1MC4RDRD4LMNA
SCHEMBL1415730 0.89 SIGMAR1 (1.00) CCR3SIGMAR1MC4RDRD4LMNA
SCHEMBL2489199 0.89 SIGMAR1 (1.00) CCR3SIGMAR1MC4RDRD4LMNA
SCHEMBL242970 0.89 SIGMAR1 (1.00) CCR3SIGMAR1MC4RDRD4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1160267-B1 CATALYST FOR OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, METHOD OF OXIDATIVE POLYMERIZATION OF FLUOROPHENOL, AND POLY(OXYFLUOROPHENYLENE) DERIVATIVE JAPAN SCIENCE & TECH CORP (JP) 2004-08-04 EP disclosed