SCHEMBL26464680

SCHEMBL26464680

Oc1ccc(-c2c[nH]c(-c3ccc(Br)cc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPT P10636 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
TP53 P04637 1/20 0.47
MAPK13 O15264 1/20 0.47
GCGR P47871 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47
MAPK14 Q16539 1/20 0.47
ALOX15 P16050 1/20 0.45
ALDH1A1 P00352 3/20 0.41
HPGD P15428 2/20 0.41
GLB1 P16278 1/20 0.41
CTRB1 P17538 1/20 0.41
CTRC Q99895 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL17707841 0.91 ALDH1A1 (0.48) MEN1KMT2AMAPTSMN1; SMN2TP53
SCHEMBL7139439 0.84 DGAT1 (0.51) MEN1KMT2AMAPTSMN1; SMN2TP53
SCHEMBL7143721 0.84 DGAT1 (0.51) MEN1KMT2AMAPTSMN1; SMN2TP53
SCHEMBL7143264 0.84 MEN1 (0.53) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL23819957 0.83 APP (0.46) MEN1KMT2AMAPTSMN1; SMN2TP53
SCHEMBL26464181 0.83 MAPT (0.50) MEN1KMT2AMAPTSMN1; SMN2HTT
SCHEMBL26464666 0.79 MCL1 (0.47) MEN1KMT2AMAPTSMN1; SMN2HTT
SCHEMBL11614979 0.79 APP (0.50) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL10558941 0.78 ALDH1A1 (0.44) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL27719395 0.78 ESR1 (0.52) MEN1KMT2AMAPTSMN1; SMN2LMNA

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
WO-2023073115-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-04 WO disclosed
EP-4173485-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-03 EP disclosed