SCHEMBL9429934

SCHEMBL9429934

COc1cc2c(cc1OC)C(O)C(C)=NN=C2c1ccccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CHRM1 P11229 1/20 0.45
PDE4A P27815 1/20 0.45
PDE4D Q08499 1/20 0.45
PDE3A Q14432 1/20 0.45
NPSR1 Q6W5P4 3/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
TSHR P16473 4/20 0.38
TP53 P04637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
PDE10A Q9Y233 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
SCHEMBL7437412 0.84 MEN1 (0.66) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL9429925 0.82 KMT2A (0.54) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL9363204 0.81 PDE4D (0.51) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5198155 0.73 MEN1 (0.69) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5425871 0.73 MEN1 (0.69) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL5424934 0.73 MEN1 (0.69) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL7441797 0.72 MEN1 (0.67) MEN1KMT2ACHRM1PDE4APDE4D
SCHEMBL7444355 0.71 MAPT (0.55) MEN1KMT2ANPSR1MAPTSMN1; SMN2
SCHEMBL9067037 0.71 KMT2A (0.53) MEN1KMT2ACHRM1PDE4APDE4D
Hydrochloric Acid SCHEMBL7433736 0.70 MAPT (0.54) MEN1KMT2ANPSR1MAPTSMN1; SMN2

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
US-5288863-A Cyclization; reacting hydrazine with an acetonyl-, chloro-, dimethoxybenzophenone EGIS GYOGYSZERGYAR RT. (HU) 1994-02-22 US disclosed