SCHEMBL29152146

SCHEMBL29152146

Cc1ccccc1-c1c2ccccc2c(C#N)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 4/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
GRIA2 P42262 1/20 0.37
GRIA4 P48058 1/20 0.37
AR P10275 1/20 0.37

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
SCHEMBL7123301 0.83 CYP1A2 (0.48) ALDH1A1KDM4ETSHRGAANPC1
SCHEMBL29152128 0.77 CUL4A (0.44) LMNAALDH1A1KDM4ETSHRMEN1
SCHEMBL29152139 0.77 KDM4E (0.50) ALDH1A1KDM4ETSHRMEN1GAA
SCHEMBL29152132 0.77 KDM4E (0.54) LMNAALDH1A1KDM4ETSHRMEN1
SCHEMBL29429129 0.76 ALDH1A1 (0.64) ALDH1A1KDM4ETSHRMEN1GAA
SCHEMBL150623 0.76 ALDH1A1 (0.64) ALDH1A1KDM4ETSHRMEN1GAA
SCHEMBL22036106 0.76 LMNA (0.44) LMNAALDH1A1KDM4ETSHRKMT2A
SCHEMBL3722165 0.74 CYP1A2 (0.43) ALDH1A1KDM4ETSHRMEN1GAA
SCHEMBL12495375 0.74 ALDH1A1 (0.52) ALDH1A1KDM4ETSHRMEN1GAA
SCHEMBL14079235 0.74 ALDH1A1 (0.44) LMNAALDH1A1KDM4ETSHRMEN1

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-117164478-A Method for preparing anthracycline derivative 苏州大学 2023-12-05 CN disclosed