SCHEMBL7460163

SCHEMBL7460163

O=CNCC(CCCN1CCC(O)(c2ccc(C(F)(F)F)cc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 16/20 0.66
CCR1 P32246 15/20 0.66

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 SCHEMBL7461977 0.99 CCR3 (0.65) CCR3CCR1
SCHEMBL7470954 0.92 CCR3 (0.61) CCR3CCR1
SCHEMBL7459178 0.91 CCR3 (0.56) CCR3CCR1
SCHEMBL7461534 0.91 CCR1 (0.64) CCR3CCR1
Hydrochloric Acid SCHEMBL7461078 0.91 CCR3 (0.60) CCR3CCR1
Hydrochloric Acid SCHEMBL7463492 0.90 CCR3 (0.55) CCR3CCR1
Hydrochloric Acid SCHEMBL7459913 0.90 CCR1 (0.63) CCR3CCR1
SCHEMBL7464621 0.89 CCR3 (0.72) CCR3CCR1
Hydrochloric Acid SCHEMBL7470140 0.88 CCR3 (0.71) CCR3CCR1
SCHEMBL7462124 0.87 CCR1 (0.67) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1219294-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP claimed
EP-1219294-A1 MELANIN CONCENTRATING HORMONE ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed