SCHEMBL8106831

SCHEMBL8106831

CC(C)CCCCCCN1CCN(Cc2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.64
MC4R P32245 1/20 0.57
SIGMAR1 Q99720 2/20 0.56
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
HTR7 P34969 1/20 0.50

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
SCHEMBL8106645 0.98 CCR3 (0.66) CCR3MC4RSIGMAR1KDM4EMEN1
SCHEMBL14525251 0.87 MC4R (0.65) CCR3MC4RSIGMAR1KDM4EMEN1
SCHEMBL6657649 0.87 CCR3 (0.82) CCR3MC4RSIGMAR1LMNAPOLB
SCHEMBL22802249 0.86 ALDH1A1 (0.54) CCR3MEN1KMT2ALMNAPOLB
SCHEMBL22802899 0.86 ALDH1A1 (0.54) CCR3MEN1KMT2ALMNAPOLB
SCHEMBL22802253 0.86 ALDH1A1 (0.54) CCR3MEN1KMT2ALMNAPOLB
SCHEMBL22802250 0.86 ALDH1A1 (0.54) CCR3MEN1KMT2ALMNAPOLB
SCHEMBL22802902 0.85 LMNA (0.59) CCR3SIGMAR1LMNA
SCHEMBL22802896 0.85 LMNA (0.59) CCR3SIGMAR1LMNA
SCHEMBL6657455 0.85 CCR3 (0.85) CCR3MC4RSIGMAR1LMNAPOLB

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-0632031-B1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 2000-05-03 EP disclosed
US-5496853-A FOR TREATING HYPERCHOLESTEROLEMIA TEIJIN LIMITED (JP) 1996-03-05 US disclosed
EP-0632031-A1 CONDENSED BENZOXA RING COMPOUND, PRODUCTION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1995-01-04 EP disclosed