SCHEMBL15412486

SCHEMBL15412486

CCCc1c(C(F)(F)F)cnc(N)c1N

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 1/20 0.39
USP7 Q93009 1/20 0.37
MBOAT4 Q96T53 3/20 0.35
PIK3CA P42336 6/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
AR P10275 2/20 0.32
MAP3K12 Q12852 4/20 0.32
AURKA O14965 1/20 0.31
KDR P35968 1/20 0.31
AURKB Q96GD4 1/20 0.31
DDR1 Q08345 1/20 0.31
PIK3CD O00329 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 1/20 0.30
PIK3C3 Q8NEB9 1/20 0.30
PI4KB Q9UBF8 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
SCHEMBL3449189 0.86 MBOAT4 (0.36) NOS2USP7MBOAT4PIK3CAMAP3K12
SCHEMBL15863024 0.79 MBOAT4 (0.34) MBOAT4PIK3CAPOLBMAP3K12
SCHEMBL24869145 0.76 NPC1 (0.39) NOS2USP7PIK3CAARMAP3K12
SCHEMBL5368853 0.74 NOS2 (0.43) NOS2USP7KDM4EPOLB
SCHEMBL9276814 0.72 MBOAT4 (0.36) NOS2USP7MBOAT4PIK3CAMAP3K12
SCHEMBL29435785 0.72 MBOAT4 (0.36) NOS2USP7MBOAT4PIK3CAMAP3K12
SCHEMBL26799169 0.71 AR (0.39) NOS2KDM4EPOLBAR
Ammonia Solution, Strong SCHEMBL16280437 0.71 MBOAT4 (0.35) NOS2MBOAT4PIK3CAMAP3K12AURKA
SCHEMBL3285596 0.71 NOS2 (0.47) NOS2USP7KDM4E
SCHEMBL16668061 0.69 MAP3K12 (0.36) MBOAT4PIK3CAKDM4EMAP3K12AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3006429-B1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO (JP) 2019-02-06 EP disclosed
EP-2655337-B1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO (JP) 2016-11-23 EP disclosed
EP-3006429-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL CO., LTD. (JP) 2016-04-13 EP disclosed
US-9278983-B2 Fused heterocyclic compound and use thereof for pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-08 US disclosed
US-20140364444-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-12-11 US disclosed
US-8853238-B2 Fused heterocyclic compound and use thereof for pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-10-07 US disclosed
US-20140018373-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140018373-A1 FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF NR4A1, NR2C2, NR0B1 NOS2 1234/4885USP7 921/4885MBOAT4 3730/4885
US-20140364444-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL NR4A1, NR2C2, NR0B1 NOS2 1161/4885USP7 968/4885MBOAT4 3664/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.