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SCHEMBL8554871

SCHEMBL8554871

Clc1ccc(OCc2nc3c(OCCC[C@H]4CCCNC4)c(CCCC4CCCNC4)ccc3[nH]2)cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 18/20 0.50
▸ NPC1 O15118 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL8551284 1.00 NPY1R (0.50) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8555173 0.94 NPY1R (0.49) NPY1R
SCHEMBL8554556 0.89 NPY1R (0.51) NPY1RHRH4
SCHEMBL8551656 0.85 NPY1R (0.50) NPY1RHRH4
SCHEMBL8554219 0.85 NPY1R (0.51) NPY1RNPC1POLBRAB9ASMN1; SMN2
SCHEMBL8555992 0.83 NPY1R (0.51) NPY1RHRH4
SCHEMBL8553094 0.82 NPY1R (0.50) NPY1R
SCHEMBL8553363 0.82 NPY1R (0.48) NPY1R
SCHEMBL8553288 0.82 NPY1R (0.53) NPY1R
SCHEMBL8553571 0.80 NPY1R (0.45) NPY1RNPC1POLBRAB9ASMN1; SMN2

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-0871442-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-10-21 — — EP disclosed
WO-1997025041-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-17 — — WO disclosed