SCHEMBL7968522

SCHEMBL7968522

CCOC(=O)CCCCn1cc(-c2ccc([C@H](c3cccc(O[Si](C)(C)C(C)(C)C)c3)N3C[C@@H](C)N(Cc4ccccc4)C[C@@H]3C)cc2)cn1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.42

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
SCHEMBL7971186 0.86 OPRD1 (0.48) OPRD1
SCHEMBL7967877 0.80
SCHEMBL7967433 0.80 OPRD1 (0.51) OPRD1
SCHEMBL7973745 0.79 OPRD1 (0.45) OPRD1
SCHEMBL7968614 0.78 OPRD1 (0.51) OPRD1
SCHEMBL7967521 0.78 OPRD1 (0.59) OPRD1
SCHEMBL7971024 0.78 EP300 (0.46)
SCHEMBL7971321 0.77 OPRD1 (0.50) OPRD1
SCHEMBL7973648 0.77
SCHEMBL7958113 0.77 OPRD1 (0.49) OPRD1

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-6200978-B1 FOR PREVENTING OR TREATING INFLAMMATORY DISEASES SUCH AS ARTHRITIS, PSORIASIS, ASTHMA, OR INFLAMMATORY BOWEL DISEASE, DISORDERS OF RESPIRATORY FUNCTION, GASTROINTESTINAL DISORDERS SUCH AS FUNCTIONAL BOWEL DISEASE, AS ANALGESICS PFIZER INC. 2001-03-13 US disclosed