SCHEMBL29743056

SCHEMBL29743056

O=C(O)n1nccc1C1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 3/20 0.36
▸ PDE3B Q13370 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PDE3A Q14432 1/20 0.35
▸ KDM5A P29375 2/20 0.33
▸ KDM5B Q9UGL1 2/20 0.33
▸ ACMSD Q8TDX5 2/20 0.33
▸ KMO O15229 2/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ SLC5A1 P13866 4/20 0.33
▸ KDM4A O75164 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ ADCY1 Q08828 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
SCHEMBL31517351 0.93 KDM4E (0.37) PDE2AKDM4EHTTPDE3AKDM5A
SCHEMBL6606933 0.84 PDE2A (0.35) PDE2APDE3BKMT2AKDM4EHTT
SCHEMBL6604117 0.81 PDE2A (0.34) PDE2APDE3BKMT2AKDM4EHTT
SCHEMBL6605266 0.76 KDM4E (0.36) PDE2AKMT2AKDM4EHTTTDP1
SCHEMBL19723894 0.69 HCAR2 (0.42) KDM4EHTTSMN1; SMN2HCAR2NR1I2
SCHEMBL19723890 0.68 HCAR2 (0.41) PDE2APDE3BKDM4EHTTHCAR2
SCHEMBL12539281 0.67 PDE2A (0.46) PDE2APDE3BPDE3AHCAR2
SCHEMBL14014971 0.66 KDM4E (0.54) PDE2APDE3BKMT2AKDM4EHTT
SCHEMBL25635468 0.65 HCAR2 (0.45) PDE2APDE3BKMT2AKDM4ESMN1; SMN2
SCHEMBL29042582 0.65 — —

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
CN-111212833-B Phenylpyridine derivatives and pharmaceutical compositions containing the same 株式会社大熊制药 2022-09-06 — — CN disclosed
EP-3696176-B1 NOVEL PHENYLPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME DAE WOONG PHARMA (KR) 2022-05-04 — — EP disclosed
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