SCHEMBL14768684

SCHEMBL14768684

O=C1CCC(N2CCN(c3ccccc3F)CC2)CC1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
GLA P06280 1/20 0.49
TP53 P04637 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TSHR P16473 1/20 0.47
PAX8 Q06710 1/20 0.46
LMNA P02545 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
GRIN2B Q13224 1/20 0.45

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
SCHEMBL13698464 0.83 ABCB1 (0.62) KDM4EGLASMN1; SMN2ALDH1A1MEN1
SCHEMBL1361317 0.80 ALDH1A1 (0.54) KDM4EGLASMN1; SMN2ALDH1A1MEN1
SCHEMBL13698473 0.80 MEN1 (0.53) KDM4EGLATP53SMN1; SMN2ALDH1A1
SCHEMBL6635193 0.78 KDM4E (0.62) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL9872464 0.78 GRIN2B (0.73) KDM4EALDH1A1MEN1KMT2ACYP2C9
SCHEMBL13468008 0.78 L3MBTL3 (0.59) KDM4EGLAMEN1KMT2ALMNA
SCHEMBL13698472 0.77 HSD17B10 (0.51) KDM4EGLASMN1; SMN2ALDH1A1MEN1
SCHEMBL14761576 0.74 LMNA (0.48) KDM4EGLATP53SMN1; SMN2ALDH1A1
SCHEMBL13698476 0.72 ALDH1A1 (0.70) SMN1; SMN2ALDH1A1MEN1KMT2ATSHR
SCHEMBL12865073 0.72 OPRM1 (0.52) KDM4EGLASMN1; SMN2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2576520-A1 RADIOLABELED COMPOUNDS AND METHODS THEREOF GE Healthcare UK Limited (GB) 2013-04-10 EP disclosed
US-20130064770-A1 RADIOLABELED COMPOUNDS AND METHODS THEREOF GE HEALTHCARE LIMITED (GB) 2013-03-14 US disclosed
US-20130064770-A1 RADIOLABELED COMPOUNDS AND METHODS THEREOF GE HEALTHCARE LIMITED (GB) 2013-03-14 US disclosed
WO-2011150183-A1 RADIOLABELED COMPOUNDS AND METHODS THEREOF GE HEALTHCARE LIMITED (GB) 2011-12-01 WO disclosed
WO-2011150183-A1 RADIOLABELED COMPOUNDS AND METHODS THEREOF GE HEALTHCARE LIMITED (GB) 2011-12-01 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-20130064770-A1 RADIOLABELED COMPOUNDS AND METHODS THEREOF HTR5A, HTR3B, HTR1A KDM4E 3727/4885GLA 2806/4885TP53 3538/4885

“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.