SCHEMBL4475842

SCHEMBL4475842

COC(=O)C1C(=O)CCN(N2CCCCC2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
FKBP1A P62942 1/20 0.32
POLB P06746 1/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL978323 0.84 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL4718434 0.84 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL6646578 0.80 ACE (0.31) KMT2A
SCHEMBL16494534 0.76 BRD4 (0.44) BRD4CYP1A2HIF1AALDH1A1FKBP1A
SCHEMBL7022793 0.74 BRD4 (0.37) BRD4SMN1; SMN2CYP1A2HIF1AALDH1A1
SCHEMBL16495148 0.71 BRD4 (0.40) BRD4SMN1; SMN2CYP1A2HIF1AALDH1A1
SCHEMBL10818686 0.70 BRD4 (0.39) BRD4SMN1; SMN2CYP1A2HIF1AALDH1A1
SCHEMBL6098996 0.69 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1KDM4EHSD17B10POLB
SCHEMBL2597463 0.69 BRD4 (0.45) BRD4CYP1A2HIF1AALDH1A1KDM4E
SCHEMBL8394065 0.68 FKBP1A (0.36) BRD4CYP1A2HIF1AKDM4EFKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576095-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-08-18 US disclosed
US-7576095-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-08-18 US disclosed
US-7576095-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-08-18 US disclosed
WO-2008120000-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2008-10-09 WO disclosed
US-20080009513-A1 Therapeutic agents ASTRAZENECA AB (SE) 2008-01-10 US disclosed
US-20080009513-A1 Therapeutic agents ASTRAZENECA AB (SE) 2008-01-10 US disclosed
US-20080009513-A1 Therapeutic agents ASTRAZENECA AB (SE) 2008-01-10 US 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-20080009513-A1 Therapeutic agents NLN, GPR119, FABP4 BRD4 1346/4885SMN1; SMN2 275/4885CYP1A2 749/4885

“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.