SCHEMBL29886117

SCHEMBL29886117

COC(=O)c1c(Cl)cc(Cl)nc1NC=NO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ ABL1 P00519 1/20 0.31
▸ SRC P12931 1/20 0.31
▸ PLA2G2A P14555 1/20 0.31
▸ NQO2 P16083 3/20 0.31
▸ MRGPRX4 Q96LA9 1/20 0.30
▸ TSHR P16473 2/20 0.30
▸ HSD17B10 Q99714 2/20 0.30
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30

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
SCHEMBL21403274 1.00 KDM4E (0.36) KDM4EL3MBTL1ALOX15ALDH1A1SMN1; SMN2
SCHEMBL21403273 1.00 KDM4E (0.36) KDM4EL3MBTL1ALOX15ALDH1A1SMN1; SMN2
SCHEMBL1710208 0.77 KDM4E (0.44) KDM4EL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL31682572 0.76 TUBB4A (0.44) KDM4EL3MBTL1ALOX15ALDH1A1SMN1; SMN2
SCHEMBL19958207 0.74 KDM4E (0.42) KDM4EL3MBTL1ALOX15ALDH1A1SMN1; SMN2
SCHEMBL19959594 0.74 KDM4E (0.42) KDM4EL3MBTL1ALOX15ALDH1A1SMN1; SMN2
SCHEMBL12380495 0.74 KDM4E (0.44) KDM4EL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL8521535 0.72 KDM4E (0.39) KDM4EL3MBTL1ALOX15ALDH1A1SMN1; SMN2
SCHEMBL17054798 0.72 KDM4E (0.40) KDM4EL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL24070302 0.71 KDM4E (0.42) KDM4EL3MBTL1ALDH1A1SMN1; SMN2KMT2A

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
CN-110214139-B Process for producing triazolopyridine compound 日本烟草产业株式会社 2022-08-23 — — CN disclosed
Send feedback