SCHEMBL15426487

SCHEMBL15426487

CNc1ncc(C(C)(F)F)cc1N

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CFTR P13569 2/20 0.36
MAP4K1 Q92918 1/20 0.32
ALDH1A1 P00352 3/20 0.32
GAA P10253 2/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
MBOAT4 Q96T53 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
RXRA P19793 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30
GCK P35557 1/20 0.30
GCKR Q14397 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
SCHEMBL115114 0.87 CFTR (0.43) CFTRALDH1A1GAAKDM4EPOLB
SCHEMBL29431605 0.87 CFTR (0.43) CFTRALDH1A1GAAKDM4EPOLB
SCHEMBL10280736 0.84 CFTR (0.35) CFTRALDH1A1GAAKDM4EPOLB
SCHEMBL15426485 0.79 SMN1; SMN2 (0.31) ALDH1A1KDM4EPOLBSMN1; SMN2CYP3A4
SCHEMBL9952855 0.73 IDO1 (0.35)
SCHEMBL18819874 0.72 TRPA1 (0.35) CFTRGAASMN1; SMN2CYP1A2CYP3A4
SCHEMBL2265758 0.71 NOS3 (0.45) ALDH1A1GAAKDM4ESMN1; SMN2CYP1A2
SCHEMBL2241231 0.69 MEN1 (0.37) ALDH1A1GAASMN1; SMN2CYP3A4LMNA
SCHEMBL1619871 0.69 KMT2A (0.43) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C19
SCHEMBL28736519 0.69 PIK3CD (0.46) ALDH1A1GAAGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9278983-B2 Fused heterocyclic compound and use thereof for pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-08 US disclosed
US-9156838-B2 Fused heterocyclic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-13 US disclosed
US-20150246911-A1 FUSED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-09-03 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 (3 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 CFTR 2950/4885MAP4K1 4313/4885ALDH1A1 3178/4885
US-20150246911-A1 FUSED HETEROCYCLIC COMPOUND NR4A1, NR4A3, NR4A2 CFTR 654/4885MAP4K1 3247/4885ALDH1A1 3032/4885
US-20140364444-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL NR4A1, NR2C2, NR0B1 CFTR 3185/4885MAP4K1 4251/4885ALDH1A1 3047/4885

“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.