SCHEMBL7660410

SCHEMBL7660410

N#Cc1cccc(-c2ccc(CO)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.55
MMP13 P45452 1/20 0.55
HDAC8 Q9BY41 1/20 0.53
XDH P47989 1/20 0.50
SLC22A12 Q96S37 1/20 0.50
PTPN5 P54829 1/20 0.50
MME P08473 1/20 0.48
CLK4 Q9HAZ1 1/20 0.47
AURKA O14965 1/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
PGR P06401 2/20 0.44
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
MMP3 P08254 1/20 0.44
PDK2 Q15119 1/20 0.43
NR3C2 P08235 1/20 0.43
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
PRKCI P41743 1/20 0.43

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
SCHEMBL688074 0.87 PRKCI (0.53) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL2771783 0.86 MMP12 (0.59) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL15245751 0.84 LOXL2 (0.59) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL27787243 0.82 CLK4 (0.63) XDHSLC22A12PTPN5CLK4PGR
SCHEMBL10244532 0.82 CYP2A6 (0.57) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL9846008 0.82 MMP12 (0.51) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL8982347 0.82 CYP2A6 (0.57) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL16675765 0.82 PRKCI (0.56) MMP12MMP13HDAC8MMP3PRKCI
SCHEMBL19608719 0.81 TSHR (0.58) MMP12MMP13HDAC8XDHSLC22A12
SCHEMBL12807987 0.81 MMP3 (0.58) MMP12MMP13HDAC8MMP3

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-6348478-B1 BLOOD COAGULATION FACTORS AND ANTICOAGULANTS TEIJIN LIMITED (JP) 2002-02-19 US disclosed
EP-1043311-A1 BIPHENYLAMIDINE DERIVATIVES TEIJIN LIMITED (JP) 2000-10-11 EP disclosed