SCHEMBL9623034

SCHEMBL9623034

COc1ccc2[nH]c3ccc4c(c3c2c1)C(=O)N(CCN(C)C)C4=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.47
PLK1 P53350 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
HTR6 P50406 4/20 0.45
HTR1A P08908 3/20 0.45
HTR1D P28221 3/20 0.45
HTR7 P34969 3/20 0.45
HTR5A P47898 3/20 0.45
HTR1E P28566 2/20 0.45
SLC6A2 P23975 1/20 0.45
MAPT P10636 4/20 0.44
ALDH1A1 P00352 2/20 0.44
MYLK Q15746 1/20 0.44
APEX1 P27695 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PDGFRB P09619 1/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL29351752 0.87 TERT (0.47) TERTPLK1HTR6ALDH1A1TDP1
SCHEMBL9623078 0.87 TERT (0.47) TERTPLK1HTR6ALDH1A1TDP1
SCHEMBL9622455 0.87 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1APEX1
SCHEMBL9622882 0.87 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1APEX1
SCHEMBL29386554 0.85 PDGFRB (0.48) TERTMEN1KMT2AHTR6HTR1A
SCHEMBL9622438 0.84 TERT (0.49) TERTPLK1MEN1KMT2AHTR6
SCHEMBL9623021 0.84 WEE1 (0.51) TERTMEN1KMT2AMYLKTDP1
SCHEMBL29358400 0.84 TERT (0.49) TERTPLK1MEN1KMT2AHTR6
Hydrochloric Acid SCHEMBL9623357 0.83 WEE1 (0.50) TERTMEN1KMT2AMYLKTDP1
SCHEMBL9623119 0.83 MYLK (0.47) TERTPLK1MEN1KMT2AHTR6

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-5166204-A ISOINDOLE DERIVATIVES AND SALTS THEREOF AND ANTITUMOR AGENT COMPRISING THE SAME TOYAMA CHEMICAL CO., LTD. (JP) 1992-11-24 US disclosed