SCHEMBL8908604

SCHEMBL8908604

COC(=O)CCC(=O)N1CCC(C(=O)NCC(CCCN2CCC(O)(c3ccc(Cl)cc3)CC2)(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 18/20 0.68
CCR1 P32246 16/20 0.68

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 SCHEMBL8891622 0.99 CCR3 (0.67) CCR3CCR1
SCHEMBL8891810 0.89 CCR3 (0.65) CCR3CCR1
Hydrochloric Acid SCHEMBL8892686 0.88 CCR3 (0.64) CCR3CCR1
Hydrochloric Acid SCHEMBL8907853 0.87 CCR3 (0.72) CCR3CCR1
Hydrochloric Acid SCHEMBL8891717 0.87 CCR3 (0.71) CCR3CCR1
Hydrochloric Acid SCHEMBL8891923 0.86 CCR3 (0.66) CCR3CCR1
Hydrochloric Acid SCHEMBL8892899 0.86 CCR3 (0.66) CCR3CCR1
Hydrochloric Acid SCHEMBL8892177 0.86 CCR3 (0.70) CCR3CCR1
SCHEMBL8921760 0.86 CCR3 (0.61) CCR3CCR1
SCHEMBL8891618 0.86 CCR1 (0.79) CCR3CCR1

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
WO-1997024325-A1 DIPHENYLMETHANE DERIVATIVES AS MIP-1α/RANTES RECEPTOR ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-10 WO disclosed