SCHEMBL3652154

SCHEMBL3652154

COc1cc(Nc2ccc(Oc3cccc(N4CCN(C)CC4)c3)cn2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNK O75909 2/20 0.47
CCNA2 P20248 2/20 0.47
CDK2 P24941 2/20 0.47
CCND3 P30281 2/20 0.47
CDK9 P50750 2/20 0.47
CDK6 Q00534 2/20 0.47
CTSC P53634 3/20 0.46
EGFR P00533 2/20 0.46
ERBB3 P21860 1/20 0.46
STK33 Q9BYT3 1/20 0.45
FGFR3 P22607 1/20 0.44
GALR2 O43603 1/20 0.43
GALR1 P47211 1/20 0.43
BRD4 O60885 6/20 0.43
JAK2 O60674 1/20 0.43
BCL6 P41182 1/20 0.42
AURKA O14965 1/20 0.42
CDK4 P11802 1/20 0.42
HTR1A P08908 1/20 0.42
HTR1D P28221 1/20 0.42

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
SCHEMBL3649390 0.92 GALR2 (0.44) CCNKCCNA2CDK2CCND3CDK9
SCHEMBL8068266 0.90 MET (0.49) CDK2CDK9GALR2GALR1JAK2
SCHEMBL3657530 0.86 CTSC (0.47) CCNKCCNA2CDK2CCND3CDK9
SCHEMBL3706813 0.82 MET (0.54) CCNKCCNA2CDK2CCND3CDK9
SCHEMBL3653329 0.80 TGFBR1 (0.46) EGFRERBB3
SCHEMBL3651458 0.79 APP (0.48) EGFRERBB3JAK2
SCHEMBL3655769 0.79 GRM4 (0.41) GALR2GALR1BRD4BCL6
SCHEMBL3654890 0.79 RAF1 (0.47) CCNA2CDK2EGFRERBB3JAK2
SCHEMBL3656271 0.78 EGFR (0.47) EGFRERBB3
SCHEMBL27797431 0.77 GALR2 (0.46) STK33FGFR3GALR2GALR1

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
US-20100298325-A1 PYRIDINE DERIVATIVES FOR THE TREATMENT OF AMYLOID-RELATED DISEASES SENEXIS LIMITED (GB) 2010-11-25 US 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

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 CCNK 4280/4885CCNA2 4013/4885CDK2 4492/4885

“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.