SCHEMBL10967673

SCHEMBL10967673

OCc1ccccc1-c1cccnc1.c1ccc(-c2ccc(COCc3ccc(-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.55
MKNK2 Q9HBH9 1/20 0.55
KCNA5 P22460 4/20 0.50
USP1 O94782 2/20 0.50
WDR48 Q8TAF3 2/20 0.50
KCNH2 Q12809 2/20 0.48
EPHX1 P07099 1/20 0.45
CYP11B1 P15538 4/20 0.44
CYP11B2 P19099 4/20 0.44
CYP19A1 P11511 2/20 0.44
CYP2A6 P11509 1/20 0.44
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TACR1 P25103 1/20 0.42
PTGS2 P35354 1/20 0.42
GBA1 P04062 2/20 0.41
UGCG Q16739 1/20 0.41
GBA2 Q9HCG7 1/20 0.41

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
SCHEMBL477395 0.84 KCNA5 (0.61) MKNK1MKNK2KCNA5USP1WDR48
SCHEMBL17301108 0.78 EPHX1 (0.58) EPHX1LMNAHTTKMT2A
SCHEMBL7951583 0.75 PDCD1 (0.61) KCNA5KCNH2CYP11B1CYP11B2CYP2A6
SCHEMBL10967675 0.74 SMN1; SMN2 (0.64) MKNK1MKNK2KCNA5KCNH2CYP2A6
SCHEMBL13316730 0.74 TSHR (0.48) KCNA5KCNH2CYP11B1CYP11B2CYP19A1
SCHEMBL10966421 0.74 KCNA5 (0.54) MKNK1MKNK2KCNA5KCNH2EPHX1
SCHEMBL10968046 0.74 KIF11 (0.49) MKNK1MKNK2EPHX1CYP11B1CYP11B2
Biphenyl SCHEMBL11301140 0.73 PDCD1 (0.63) KCNA5KCNH2CYP11B1CYP11B2CYP2A6
SCHEMBL10966235 0.73 KIF11 (0.46) KCNA5KCNH2EPHX1CYP11B1CYP11B2
SCHEMBL11552077 0.73 CYP11B1 (0.69) MKNK1MKNK2KCNA5KCNH2CYP11B1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0148826-A1 FUNGICIDAL, HERBICIDAL AND PLANT GROWTH REGULATING PYRIDYL-CONTAINING ETHERS CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1985-07-24 EP disclosed
WO-1985000289-A1 FUNGICIDAL, HERBICIDAL AND PLANT GROWTH REGULATING PYRIDYL-CONTAINING ETHERS CHEVRON RESEARCH COMPANY (US) 1985-01-31 WO disclosed
US-4407806-A PRE- AND POSTEMERGENCE HERBICIDES CHEVRON RESEARCH COMPANY (US) 1983-10-04 US disclosed