SCHEMBL8487152

SCHEMBL8487152

CN(CCOc1ccccc1C=O)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.62
HTR1B P28222 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.57
ALDH1A1 P00352 1/20 0.57
HPGD P15428 1/20 0.57
HTT P42858 1/20 0.57
LMNA P02545 1/20 0.56
TSHR P16473 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.53
ATM Q13315 2/20 0.50
HTR6 P50406 1/20 0.50
DRD2 P14416 1/20 0.49
DRD1 P21728 1/20 0.49
DRD4 P21917 1/20 0.49
DRD5 P21918 1/20 0.49
PTGDR2 Q9Y5Y4 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAOB P27338 1/20 0.47

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
SCHEMBL11394252 0.93 LMNA (0.66) HTR1DHTR1BSMN1; SMN2ALDH1A1HPGD
SCHEMBL8393097 0.84 GAA (0.61) HTR1DHTR1BSMN1; SMN2LMNATSHR
SCHEMBL11735898 0.83 ALDH1A1 (0.62) HTR1DHTR1BSMN1; SMN2ALDH1A1HPGD
SCHEMBL8706674 0.83 MEN1 (0.64) HTR1DHTR1BTSHRATMMEN1
Hydrochloric Acid SCHEMBL8392166 0.82 MEN1 (0.62) HTR1DHTR1BTSHRATMMEN1
SCHEMBL8699166 0.81 HTR1D (0.57) HTR1DHTR1BSMN1; SMN2LMNATSHR
SCHEMBL4888000 0.81 ALDH1A1 (0.69) HTR1BSMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL28086775 0.81 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1HPGDHTTLMNA
Hydrochloric Acid SCHEMBL6561435 0.80 ALDH1A1 (0.67) HTR1BSMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL3888894 0.79 LMNA (0.86) HTR1DHTR1BSMN1; SMN2LMNATSHR

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-5925656-A CONTAINING A 2,4-DIOXOTRIAZOLIDINE RING DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-07-20 US disclosed