SCHEMBL9906960

SCHEMBL9906960

CC1=CCC2C(=O)N(C)C(=O)C2C1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
TSHR P16473 4/20 0.51
TDP1 Q9NUW8 3/20 0.51
POLB P06746 3/20 0.51
GAA P10253 2/20 0.51
APEX1 P27695 1/20 0.51
KMT2A Q03164 6/20 0.49
MEN1 O00255 3/20 0.49
USP2 O75604 1/20 0.49
RXFP1 Q9HBX9 1/20 0.47
HPGD P15428 2/20 0.46
MAPT P10636 1/20 0.41
ESR1 P03372 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL24303345 0.79 TSHR (0.48) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL14303663 0.78 ALDH1A1 (0.65) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL9550342 0.78 TSHR (0.50) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL18485432 0.78 ALDH1A1 (0.52) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL2076853 0.78 ALDH1A1 (0.47) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL11531787 0.75 POLB (0.48) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL10099733 0.75 GAA (0.62) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL10903773 0.75 GAA (0.66) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL10903800 0.75 NPSR1 (0.68) ALDH1A1TSHRTDP1POLBGAA
SCHEMBL10904279 0.74 GAA (0.60) ALDH1A1TSHRTDP1POLBGAA

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
US-8637585-B2 Silsesquioxane photoinitiators BASF SE (DE) 2014-01-28 US disclosed
US-20120142793-A1 SILSESQUIOXANE PHOTOINITIATORS BASF SE (DE) 2012-06-07 US disclosed