SCHEMBL6722994

SCHEMBL6722994

Cc1cc(B(O)O)c(F)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.38
CYP3A4 P08684 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33
PTGS2 P35354 2/20 0.33
MAPT P10636 1/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32

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
SCHEMBL13299606 0.91 CD44 (0.38) CD44CYP3A4LMNASMN1; SMN2NPC1
SCHEMBL29950958 0.83 SMN1; SMN2 (0.32) CYP3A4SMN1; SMN2NPC1RAB9AHTR3E
SCHEMBL15757290 0.83 SMN1; SMN2 (0.32) CYP3A4SMN1; SMN2NPC1RAB9AHTR3E
SCHEMBL25170326 0.82 KDM1A (0.35) SMN1; SMN2ALDH1A1MAPTPOLBAPEX1
SCHEMBL5301120 0.81 ACHE (0.31)
SCHEMBL2914323 0.79 DAO (0.32)
SCHEMBL20956940 0.79 CD44 (0.42) CD44CYP3A4LMNASMN1; SMN2NPC1
SCHEMBL15279773 0.79 CD44 (0.42) CD44CYP3A4LMNASMN1; SMN2KDM4E
SCHEMBL29955299 0.79 DAO (0.32)
SCHEMBL2596742 0.77 ALDH1A1 (0.34) LMNASMN1; SMN2NPC1RAB9AALDH1A1

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
CN-115701430-A Isoxazoline-containing phenylpyridine compound and application thereof 沈阳禧沅峰生物科技有限公司 2023-02-10 CN disclosed
US-20040092402-A1 Pyrimidine derivatives and herbicides containing the same SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2004-05-13 US disclosed
EP-1333029-A1 PYRIMIDINE DERIVATIVES AND HERBICIDES CONTAINING THE SAME Sumitomo Chemical Takeda Agro Company, Limited (JP) 2003-08-06 EP 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-20040092402-A1 Pyrimidine derivatives and herbicides containing the same DDX41, CBR3, DPYD CD44 4855/4885CYP3A4 663/4885LMNA 3759/4885

“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.