SCHEMBL5848396

SCHEMBL5848396

CC(C)(C)c1c(-c2cc(Cl)cc(Cl)c2)cc2c3c1[C@@H]1CN(C(=O)O)CC[C@@H]1N3CC2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.31

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
SCHEMBL5847854 0.88 HCRTR1 (0.36) CCR3
SCHEMBL5848598 0.87 TSHR (0.33) CCR3
SCHEMBL5848064 0.85 DPP4 (0.36) CCR3
SCHEMBL5849715 0.83 DRD1 (0.37) CCR3
SCHEMBL5847392 0.83 CCR3 (0.34) CCR3
SCHEMBL5847913 0.83 ABCB1 (0.35) CCR3
SCHEMBL5847193 0.82 CCR3 (0.35) CCR3
SCHEMBL5421544 0.82 CCR3 (0.33) CCR3
SCHEMBL5847107 0.80 SCD5 (0.37) CCR3
SCHEMBL5847121 0.79 CCR3 (0.35) CCR3

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
US-7081455-B2 Substituted heterocycle fused gamma-carbolines BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-25 US claimed
US-7081455-B2 Substituted heterocycle fused gamma-carbolines BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-25 US disclosed