SCHEMBL9770417

SCHEMBL9770417

Cc1cc(O)n2nc(CC(c3nc4nc(C)cc(O)n4n3)C(Cc3nc4nc(C)cc(O)n4n3)c3nc4nc(C)cc(O)n4n3)nc2n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.46
ALDH1A1 P00352 3/20 0.44
HTT P42858 1/20 0.44
KDM4E B2RXH2 2/20 0.40
TSHR P16473 1/20 0.40
POLB P06746 2/20 0.36
HPGD P15428 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CYP1A2 P05177 1/20 0.35
PDE10A Q9Y233 4/20 0.35
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL1681579 0.79 KMT2A (0.39) RECQLALDH1A1HTTKDM4EHPGD
SCHEMBL9770272 0.79 KMT2A (0.39) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL1681608 0.79 RECQL (0.54) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL7100505 0.79 RECQL (0.54) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL18358398 0.77 RECQL (0.53) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL9140975 0.77 RECQL (0.57) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL9770445 0.77 KMT2A (0.38) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL9139590 0.77 RECQL (0.53) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL6233107 0.77 RECQL (0.53) RECQLALDH1A1HTTKDM4ETSHR
SCHEMBL9770324 0.77 ALDH1A1 (0.73) RECQLALDH1A1HTTKDM4ETSHR

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-5015567-A Sensitization In The Presence Of An Organic Thioether Or A Tetra-substituted Thiourea And A Triazolopyrimidine Stabilizer FUJI PHOTO FILM CO., LTD. (JP) 1991-05-14 US disclosed