SCHEMBL9689111

SCHEMBL9689111

Cc1cnn2c(-c3ccccc3)nnc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
BRD4 O60885 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA2B P29275 1/20 0.46
ADORA1 P30542 1/20 0.46
CREBBP Q92793 1/20 0.46
PIM1 P11309 2/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
POLB P06746 1/20 0.42
MARK3 P27448 1/20 0.42
GSK3B P49841 1/20 0.42
PRKAA1 Q13131 1/20 0.42
TAOK1 Q7L7X3 1/20 0.42
PIM3 Q86V86 1/20 0.42
PBK Q96KB5 1/20 0.42
SRPK1 Q96SB4 1/20 0.42

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
SCHEMBL9690110 0.84 MAPT (0.43) KDM4EHPGDHSD17B10PIM1GABRA1
SCHEMBL9691180 0.83 HPGD (0.56) KDM4EHPGDHSD17B10TSHRNPC1
SCHEMBL9690839 0.81 HPGD (0.41) KDM4EHPGDHSD17B10POLBTSHR
SCHEMBL9690969 0.79 KDM4E (0.54) KDM4EHPGDHSD17B10PIM1GSK3B
SCHEMBL9691113 0.78 HSD11B1 (0.44) KDM4EHPGDHSD17B10GSK3BGABRA1
SCHEMBL9691130 0.78 HSD11B1 (0.43) POLBGABRA1GABRG2GABRB3GABRA2
SCHEMBL5052559 0.78 BRD4 (0.42) KDM4EHPGDHSD17B10BRD4ADORA3
SCHEMBL5061094 0.75 PIM1 (0.40) KDM4EHPGDHSD17B10BRD4ADORA3
SCHEMBL5061093 0.75 KDM4E (0.39) KDM4EHPGDHSD17B10BRD4ADORA3
SCHEMBL5061095 0.75 KDM4E (0.39) KDM4EHPGDHSD17B10BRD4ADORA3

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
CN-1060843-A TRIAZOLOPYRIDAZINE DERIVATES RHONE POULENC AGROCHIMIE (FR) 1992-05-06 CN disclosed
EP-0483027-A2 Triazolopyridazines, methods for their preparation, their use as herbicides and intermediates RHONE-POULENC AGROCHIMIE (FR) 1992-04-29 EP disclosed