SCHEMBL3746284

SCHEMBL3746284

O=C(O)CCCn1cc[c]n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.38
KDM4E B2RXH2 2/20 0.37
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
FABP4 P15090 1/20 0.35
FABP5 Q01469 1/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 1/20 0.35
PTGIR P43119 1/20 0.35
NFKB1 P19838 1/20 0.34
PMP22 Q01453 1/20 0.34
EGLN3 Q9H6Z9 2/20 0.34
KMO O15229 1/20 0.34
CSNK2A2 P19784 1/20 0.33
CSNK2A1 P68400 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33

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
SCHEMBL3734066 0.89 EGLN3 (0.44) TBXAS1MAPK1SMN1; SMN2LMNAFABP4
SCHEMBL3739734 0.70 FABP4 (0.39) TBXAS1KDM4ECYP1A2MAPK1SMN1; SMN2
SCHEMBL960665 0.69 TBXAS1 (0.40) TBXAS1KDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL959796 0.69 TBXAS1 (0.40) TBXAS1KDM4EMAPK1SMN1; SMN2LMNA
SCHEMBL5440246 0.68 TBXAS1 (0.42) TBXAS1KDM4ECYP1A2MAPK1SMN1; SMN2
SCHEMBL3489062 0.68 TBXAS1 (0.42) TBXAS1LMNAFABP4FABP5TSHR
SCHEMBL1712283 0.68 EGLN3 (0.39) TBXAS1KDM4ECYP1A2MAPK1SMN1; SMN2
SCHEMBL3731832 0.67 KDM4E (0.38) TBXAS1KDM4ECYP1A2MAPK1SMN1; SMN2
SCHEMBL22151220 0.64 KDM4E (0.53) KDM4EMAPK1FABP4FABP5TSHR
SCHEMBL6373759 0.64 ALDH1A1 (0.56) TBXAS1KDM4EMAPK1LMNAEGLN3

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-7829580-B2 Cyclic amine derivative having heteroaryl ring SANKYO COMPANY, LTD. (JP) 2010-11-09 US disclosed
US-20060270706-A1 Cyclic amine derivative having heteroaryl ring SANKYO COMPANY, LTD. (JP) 2006-11-30 US disclosed
EP-1695962-A1 CYCLIC AMINE DERIVATIVE HAVING HETEROARYL RING Sankyo Company, Limited (JP) 2006-08-30 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-20060270706-A1 Cyclic amine derivative having heteroaryl ring F12, F2, H1-3 TBXAS1 58/4885KDM4E 2289/4885CYP1A2 105/4885

“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.