SCHEMBL7797362

SCHEMBL7797362

c1ncc2c(n1)ncn2-n1cnc2cncnc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.37
HDAC6 Q9UBN7 3/20 0.35
HDAC1 Q13547 2/20 0.33
LTA4H P09960 2/20 0.32
MKNK2 Q9HBH9 1/20 0.32
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
TSHR P16473 2/20 0.31
CYP2C19 P33261 2/20 0.31
MEN1 O00255 1/20 0.31
CYP2C9 P11712 1/20 0.31
HBB P68871 1/20 0.31
KMT2A Q03164 1/20 0.31
USP2 O75604 1/20 0.30

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
SCHEMBL28340215 0.83 FDPS (0.44) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL27734755 0.73 FDPS (0.40) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL27558464 0.72 FDPS (0.37) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL6055010 0.71 FDPS (0.39) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL27783128 0.71 FDPS (0.39) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL9014630 0.71 FDPS (0.36) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL27714206 0.70 FDPS (0.38) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL6959953 0.70 FDPS (0.38) FDPSHDAC6HDAC1LTA4HALDH1A1
SCHEMBL1748495 0.69 FDPS (0.37) FDPSHDAC6HDAC1LTA4HMKNK2
SCHEMBL27734803 0.69 FDPS (0.37) FDPSHDAC6HDAC1LTA4HMKNK2

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-20010010895-A1 COLOR PHOTOGRAPHIC ELEMENT CONTAINING NITROGEN HETEROCYCLE DERIVATIVE AND INHIBITOR RELEASING COUPLER CITICORP NORTH AMERICA, INC., AS AGENT 2001-08-02 US claimed