SCHEMBL28505232

SCHEMBL28505232

O=CNc1cccc(-c2ccccn2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.57
TP53 P04637 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
LMNA P02545 3/20 0.57
CCR1 P32246 3/20 0.57
CCR5 P51681 3/20 0.57
CCR8 P51685 3/20 0.57
TDP1 Q9NUW8 3/20 0.57
ALOX15 P16050 2/20 0.57
HTT P42858 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
ALPL P05186 2/20 0.57
HSP90AA1 P07900 1/20 0.57
ALPI P09923 1/20 0.57
ALPG P10696 1/20 0.57
MAPK1 P28482 1/20 0.57
POLB P06746 2/20 0.48
CYP1A2 P05177 1/20 0.48
METAP1 P53582 1/20 0.48
BLM P54132 1/20 0.48

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
SCHEMBL20919383 0.80 KDM4E (0.68) KDM4ETP53SMN1; SMN2LMNACCR1
SCHEMBL30203797 0.79
SCHEMBL80955 0.79
SCHEMBL18211777 0.78 KDM4E (0.50) KDM4ETP53SMN1; SMN2LMNACCR1
Hydrochloric Acid SCHEMBL7237591 0.77 NPC1 (0.50) KDM4ETP53SMN1; SMN2CYP1A2NPC1
Water SCHEMBL28236237 0.77 NPC1 (0.50) KDM4ETP53SMN1; SMN2CYP1A2NPC1
SCHEMBL18891533 0.77 ALDH1A1 (0.44) KDM4ETP53SMN1; SMN2LMNATDP1
SCHEMBL10958587 0.77 KDM4E (0.63) KDM4ETP53SMN1; SMN2LMNACCR1
Hydrochloric Acid SCHEMBL7238498 0.76 NPC1 (0.49) KDM4ETP53SMN1; SMN2CYP1A2NPC1
Hydrochloric Acid SCHEMBL4902758 0.75 SMN1; SMN2 (0.61) KDM4ETP53SMN1; SMN2LMNACCR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108383779-B Preparation method of 3 '-aryl-2, 2' -bipyridine-6-formamide derivative 华侨大学 2021-02-02 CN claimed
CN-110078661-B Preparation method of 3-alkenyl-2, 2' -bipyridine-6-formamide derivative 华侨大学 2022-07-29 CN disclosed
CN-110078661-B Preparation method of 3-alkenyl-2, 2' -bipyridine-6-formamide derivative 华侨大学 2022-07-29 CN disclosed
CN-110078662-B Preparation method of 3-acyl methyl-2, 2' -bipyridine-6-formamide derivative 华侨大学 2022-03-04 CN disclosed
CN-108383779-B Preparation method of 3 '-aryl-2, 2' -bipyridine-6-formamide derivative 华侨大学 2021-02-02 CN disclosed
CN-108383779-B Preparation method of 3 '-aryl-2, 2' -bipyridine-6-formamide derivative 华侨大学 2021-02-02 CN disclosed