SCHEMBL6744977

SCHEMBL6744977

CCCN1CCN(Cc2ccccc2)CCN(Cc2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.72
MC4R P32245 1/20 0.71
LMNA P02545 1/20 0.63
POLB P06746 1/20 0.63
CCR3 P51677 1/20 0.62
DRD2 P14416 1/20 0.61
DRD4 P21917 2/20 0.58
ACHE P22303 1/20 0.56
OPRM1 P35372 1/20 0.54

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
SCHEMBL8097472 1.00 SIGMAR1 (0.72) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL6740759 0.89 CCR3 (0.69) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL13632432 0.89 CCR3 (0.69) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL19170201 0.89 CCR3 (0.69) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL6659339 0.87 SIGMAR1 (0.86) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL1244038 0.87 CCR3 (0.72) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL8723260 0.85 CCR3 (0.70) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL15800706 0.85 CCR3 (0.70) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL12040820 0.85 CCR3 (0.70) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL1415730 0.85 SIGMAR1 (1.00) SIGMAR1MC4RLMNAPOLBCCR3

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
US-6689919-B1 SOLUBLE POLY(OXYFLUOROPHENYLENE) COMPOUNDS WITH EXCELLENT HEAT RESISTANCE, MEMBRANE-FORMABILITY AND CHEMICAL STABILITY JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2004-02-10 US disclosed