SCHEMBL30977271

SCHEMBL30977271

O=Cc1ccc(N(Cc2ccccn2)Cc2ccccn2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
KDM4E B2RXH2 3/20 0.56
NR1H2 P55055 2/20 0.49
NR1H3 Q13133 2/20 0.49
ALDH3A1 P30838 1/20 0.49
ALDH1A3 P47895 1/20 0.49
MAPT P10636 4/20 0.47
LIN28A Q9H9Z2 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KCNA5 P22460 2/20 0.44
KMT2A Q03164 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
CYP2A6 P11509 1/20 0.39

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
SCHEMBL18838547 1.00 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2KDM4ENR1H2NR1H3
SCHEMBL14022292 0.84 MAPT (0.47) ALDH1A1SMN1; SMN2KDM4ENR1H2NR1H3
SCHEMBL29777383 0.81 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2NR1H2NR1H3MAPT
SCHEMBL18157925 0.81 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2NR1H2NR1H3MAPT
SCHEMBL1548457 0.79 KDM4E (0.55) ALDH1A1SMN1; SMN2KDM4EMAPTLIN28A
SCHEMBL15489522 0.78 CYP2C19 (0.55) ALDH1A1SMN1; SMN2NR1H2NR1H3MAPT
SCHEMBL17495247 0.78 L3MBTL1 (0.54) ALDH1A1SMN1; SMN2NR1H2NR1H3MAPT
SCHEMBL30097972 0.78 L3MBTL1 (0.54) ALDH1A1SMN1; SMN2NR1H2NR1H3MAPT
SCHEMBL28302567 0.78 NR1H2 (0.49) ALDH1A1SMN1; SMN2KDM4ENR1H2NR1H3
SCHEMBL28302562 0.78 NR1H2 (0.49) ALDH1A1SMN1; SMN2KDM4ENR1H2NR1H3

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-120157664-A Fluorescent probe based on dicyanomethylene-4H-pyran and preparation method and application thereof 南京师范大学 2025-06-17 CN claimed
CN-120157664-A Fluorescent probe based on dicyanomethylene-4H-pyran and preparation method and application thereof 南京师范大学 2025-06-17 CN disclosed