SCHEMBL3656271

SCHEMBL3656271

COc1cc(Nc2ccc(Oc3ccc(F)cc3)cn2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.47
ERBB3 P21860 1/20 0.47
BRAF P15056 2/20 0.46
TGFBR1 P36897 1/20 0.44
KCNH2 Q12809 2/20 0.42
SCN5A Q14524 1/20 0.42
SCN9A Q15858 1/20 0.42
ALDH1A1 P00352 2/20 0.42
USP2 O75604 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 2/20 0.42
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
GRM4 Q14833 2/20 0.41
HTT P42858 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL3653329 0.90 TGFBR1 (0.46) EGFRERBB3BRAFTGFBR1KCNH2
SCHEMBL3653545 0.85 SCN9A (0.47) KCNH2SCN5ASCN9ALCKITK
SCHEMBL3651458 0.82 APP (0.48) EGFRERBB3BRAFTGFBR1KCNH2
SCHEMBL27797431 0.80 GALR2 (0.46) ALDH1A1USP2LMNASMN1; SMN2
SCHEMBL3649390 0.80 GALR2 (0.44) TGFBR1
SCHEMBL3648806 0.79 EGFR (0.41) EGFRTGFBR1KCNH2ALDH1A1SMN1; SMN2
SCHEMBL3652154 0.78 CCNK (0.47) EGFRERBB3
SCHEMBL8068266 0.78 MET (0.49) TGFBR1KCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL3657479 0.77 TRPA1 (0.42) SCN5ASCN9A
SCHEMBL24867286 0.76 SCN9A (0.55) KCNH2SCN5ASCN9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US claimed
CN-101888877-A Pyridine derivatives for the treatment of amyloid-related diseases SENEXIS LTD 2010-11-17 CN claimed
EP-2205317-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES Senexis Limited (GB) 2010-07-14 EP claimed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 WO claimed
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US disclosed
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US disclosed
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US disclosed
CN-101888877-A Pyridine derivatives for the treatment of amyloid-related diseases SENEXIS LTD 2010-11-17 CN disclosed
EP-2205317-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES Senexis Limited (GB) 2010-07-14 EP disclosed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 WO disclosed
WO-2009044160-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2009-04-09 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-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES HCRTR1, HCRTR2, RTN3 EGFR 2285/4885ERBB3 826/4885BRAF 2706/4885

“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.