SCHEMBL24690089

SCHEMBL24690089

NCC1OC(n2ccc3ccccc32)CC1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.40
▸ DUT P33316 3/20 0.39
▸ ADRB1 P08588 1/20 0.38
▸ DNMT1 P26358 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ PNP P00491 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ TFPI2 P48307 1/20 0.34
▸ NPY4R P50391 1/20 0.34
▸ TYMS P04818 1/20 0.34
▸ PIM1 P11309 1/20 0.33
▸ CSNK2A2 P19784 1/20 0.33

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
SCHEMBL22333924 0.88 ADRB1 (0.47) MAOBADRB1DNMT1LMNASMN1; SMN2
SCHEMBL23982125 0.88 ADRB1 (0.47) MAOBADRB1DNMT1LMNASMN1; SMN2
SCHEMBL22334012 0.88 ADRB1 (0.47) MAOBADRB1DNMT1LMNASMN1; SMN2
SCHEMBL24687180 0.88 ADRB1 (0.47) MAOBADRB1DNMT1LMNASMN1; SMN2
SCHEMBL22333925 0.88 ADRB1 (0.47) MAOBADRB1DNMT1LMNASMN1; SMN2
SCHEMBL6914288 0.74 POLB (0.62) ADRB1DNMT1POLBLMNAPDE4D
SCHEMBL317816 0.74 POLB (0.62) ADRB1DNMT1POLBLMNAPDE4D
SCHEMBL594778 0.74 ADK (0.45) DUTADRB1DNMT1LMNASMN1; SMN2
SCHEMBL594779 0.74 ADK (0.45) DUTADRB1DNMT1LMNASMN1; SMN2
SCHEMBL11915452 0.73 ADRB1 (0.49) ADRB1DNMT1LMNASMN1; SMN2PNP

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
EP-3429596-B1 CYCLIC DI-NUCLEOTIDE COMPOUNDS AND METHODS OF USE IMMUNE SENSOR LLC (US) 2022-08-31 — — EP disclosed
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