SCHEMBL7973090

SCHEMBL7973090

Cc1ccc(NCc2cc[c]cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.66
MAPT P10636 4/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
ALDH1A1 P00352 3/20 0.61
L3MBTL1 Q9Y468 3/20 0.61
GAA P10253 2/20 0.61
KDM4E B2RXH2 2/20 0.61
THRB P10828 2/20 0.61
HPGD P15428 2/20 0.61
MAPK1 P28482 2/20 0.61
CASP1 P29466 2/20 0.61
POLB P06746 1/20 0.61
HSP90AA1 P07900 1/20 0.61
HSP90AB1 P08238 1/20 0.61
ALOX15 P16050 1/20 0.61
BLM P54132 1/20 0.61
PLEC Q15149 1/20 0.61
HSD17B10 Q99714 1/20 0.61
RAB9A P51151 3/20 0.58

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
SCHEMBL2115360 0.92 MAPT (0.61) HTTMAPTMEN1KMT2AALDH1A1
SCHEMBL2005375 0.85 MAPT (0.80) HTTMAPTMEN1KMT2AALDH1A1
SCHEMBL10055032 0.85 MAPT (0.80) HTTMAPTMEN1KMT2AALDH1A1
SCHEMBL3245776 0.80 MEN1 (0.56) MAPTMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL1712184 0.79 HTT (0.53) HTTMEN1KMT2AALDH1A1CA12
N-Benzyl-4-Methylaniline SCHEMBL171785 0.79 HTT (1.00) HTTMAPTMEN1KMT2AALDH1A1
SCHEMBL4573326 0.79 CHRM2 (0.53) HTTMAPTMEN1KMT2AALDH1A1
N-Benzyl-4-Methylaniline SCHEMBL28183543 0.78 HTT (0.96) HTTMAPTMEN1KMT2AALDH1A1
N-Benzyl-4-Methylaniline SCHEMBL9771340 0.78 HTT (0.96) HTTMAPTMEN1KMT2AALDH1A1
SCHEMBL4592466 0.78 MAPT (0.69) HTTMAPTMEN1KMT2AALDH1A1

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-6277958-B1 USING FLUOREN-9-YLMETHOXYCARBONYL AMINO ACIDS AND A SOLID PHASE TO FORM DIPEPTIDE; PROCESS DOES NOT USE METHYLENE CHLORIDE Aimoto, Saburho (JP) 2001-08-21 US disclosed