SCHEMBL9870733

SCHEMBL9870733

CCC[C]1C=Cc2ccccc2N1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
GAA P10253 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 1/20 0.35
P2RX4 Q99571 1/20 0.35
HTR5A P47898 2/20 0.32
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BCHE P06276 2/20 0.30
ACHE P22303 2/20 0.30
ALOX5 P09917 1/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
POLB P06746 1/20 0.30
CYP3A4 P08684 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 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
SCHEMBL18171354 0.84 MAPT (0.60) MAPTGAASMN1; SMN2RAB9AP2RX4
Iminostilbene SCHEMBL29926907 0.78 MAPT (1.00) MAPTGAASMN1; SMN2RAB9AP2RX4
Iminostilbene SCHEMBL75288 0.78 MAPT (1.00) MAPTGAASMN1; SMN2RAB9AP2RX4
Iminostilbene SCHEMBL9685179 0.76 MAPT (0.94) MAPTGAASMN1; SMN2RAB9AP2RX4
Iminostilbene SCHEMBL5063042 0.76 MAPT (0.94) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL19358 0.69 MAPT (0.68) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL29058372 0.67 GAA (0.47) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL20968079 0.67 MAPT (0.64) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL30285272 0.67 MAPT (0.64) MAPTGAASMN1; SMN2RAB9AP2RX4
SCHEMBL1246857 0.66 GAA (0.46) MAPTGAA

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-5051447-A Applying aromatic oximes to plants, seeds or soils BASF AKTIENGESELLSCHAFT (DE) 1991-09-24 US disclosed