SCHEMBL4429053

SCHEMBL4429053

O=C(NC1CCCCC1CN1CCCCC1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 6/20 0.50
▸ SSTR3 P32745 3/20 0.46
▸ HTT P42858 1/20 0.46
▸ CARM1 Q86X55 1/20 0.45
▸ PRMT6 Q96LA8 1/20 0.45
▸ MCOLN2 Q8IZK6 1/20 0.45
▸ MCOLN1 Q9GZU1 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ ADRA1D P25100 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ ADRA1B P35368 1/20 0.43

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
SCHEMBL14368806 1.00 CCR3 (0.50) CCR3SSTR3HTTCARM1PRMT6
SCHEMBL9460653 0.89 CCR3 (0.52) CCR3SSTR3HTTCARM1PRMT6
SCHEMBL8787759 0.89 CCR3 (0.52) CCR3SSTR3HTTCARM1PRMT6
SCHEMBL14368703 0.87 CHRNA7 (0.51) NPC1RAB9AALDH1A1KMT2A
SCHEMBL14392352 0.87 CHRNA7 (0.51) NPC1RAB9AALDH1A1KMT2A
SCHEMBL14392754 0.87 CCR3 (0.48) CCR3NPC1RAB9AALDH1A1KMT2A
SCHEMBL14368724 0.87 CCR3 (0.48) CCR3NPC1RAB9AALDH1A1KMT2A
SCHEMBL14368700 0.87 CCR3 (0.48) CCR3NPC1RAB9AALDH1A1KMT2A
SCHEMBL14368669 0.87 SSTR3 (0.55) CCR3SSTR3NPC1RAB9A
SCHEMBL27757345 0.87 SSTR3 (0.55) CCR3SSTR3NPC1RAB9A

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-2024359-A1 COMPOUNDS THAT ARE AGONISTS OF MUSCARINIC RECEPTORS AND THAT MAY BE EFFECTIVE IN TREATING PAIN, ALZHEIMER'S DECEASE AND/OR SCHIZOPHRENIA AstraZeneca AB (SE) 2009-02-18 — — EP disclosed
WO-2007126362-A1 COMPOUNDS THAT ARE AGONISTS OF MUSCARINIC RECEPTORS AND THAT MAY BE EFFECTIVE IN TREATING PAIN, ALZHEIMER'S DISEASE AND/OR SCHIZOPHRENIA ASTRAZENECA AB (SE) 2007-11-08 — — WO disclosed
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