SCHEMBL1666253

SCHEMBL1666253

O=C(Nc1ccccc1OC(F)(F)F)c1ccncc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B13 Q7Z5P4 2/20 0.54
ATR Q13535 1/20 0.52
NAMPT P43490 1/20 0.50
RXFP1 Q9HBX9 1/20 0.45
PDE4A P27815 2/20 0.44
PDE4B Q07343 2/20 0.44
PDE4C Q08493 2/20 0.44
PDE4D Q08499 2/20 0.44
TSHR P16473 1/20 0.44
PYGL P06737 1/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPT P10636 1/20 0.43
MCL1 Q07820 1/20 0.43
CYP11B2 P19099 1/20 0.43
GRM4 Q14833 1/20 0.43
JAK2 O60674 1/20 0.43
TYK2 P29597 1/20 0.43
EGFR P00533 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
SCHEMBL1665440 0.85 HSD17B13 (0.45) HSD17B13ATRNAMPTHPGDMAPT
SCHEMBL1665449 0.81 SMN1; SMN2 (0.56) RXFP1MAPTGRM4TYK2EPHB3
SCHEMBL1024530 0.78 P2RX1 (0.47) HSD17B13JAK2TYK2
SCHEMBL1666251 0.78 NPC1 (0.65) JAK2TYK2KDR
SCHEMBL11557556 0.77 PYGL (0.47) HSD17B13ATRNAMPTPYGLMAPT
SCHEMBL12172753 0.75 KMT2A (0.67) RXFP1PYGL
SCHEMBL16127846 0.74 RXFP1 (0.56) RXFP1TSHRMAPT
SCHEMBL15391362 0.73 MLYCD (0.57) NAMPTTSHRCYP1A2HPGDCYP2C19
SCHEMBL28072777 0.73 JAK2 (0.67) NAMPTCYP11B2GRM4JAK2TYK2
SCHEMBL16180129 0.72 IRAK4 (0.74) JAK2TYK2

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
EP-2486035-B1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL CO (JP) 2015-08-26 EP disclosed
US-8742112-B2 Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-03 US disclosed
CN-102686585-A Heterocyclic compound and its use for control of an arthropod pest SUMITOMO CHEMICAL CO 2012-09-19 CN disclosed
EP-2486035-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST Sumitomo Chemical Co., Ltd (JP) 2012-08-15 EP disclosed
US-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-02 US disclosed
WO-2011043404-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-14 WO 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 (1 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-20120196891-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST HAAO, DDT, ACHE HSD17B13 1334/4885ATR 704/4885NAMPT 1362/4885

“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.