SCHEMBL4843336

SCHEMBL4843336

COC(=O)CCCOc1cccc(CN)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.50
LTA4H P09960 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 1/20 0.45
MAOB P27338 2/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
P2RY12 Q9H244 1/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL4832834 0.96 LOXL2 (0.49) LOXL2LTA4HKDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL4935323 0.94 LOXL2 (0.48) LOXL2LTA4HKDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL27836123 0.91 LOXL2 (0.50) LOXL2LTA4HKDM4EALDH1A1GAA
SCHEMBL24675766 0.90 CNR1 (0.47) LOXL2LTA4HKDM4EALDH1A1GAA
SCHEMBL25823996 0.90 CNR1 (0.47) LOXL2LTA4HKDM4EALDH1A1GAA
SCHEMBL24675794 0.90 CNR1 (0.47) LOXL2LTA4HKDM4EALDH1A1GAA
Hydrochloric Acid SCHEMBL25249852 0.89 CNR1 (0.47) LOXL2LTA4HKDM4EALDH1A1GAA
SCHEMBL24674879 0.87 CNR1 (0.45) LOXL2KDM4EALDH1A1GAAPOLB
SCHEMBL7413008 0.87 SMN1; SMN2 (0.49) LTA4HKDM4EALDH1A1GAAHPGD
SCHEMBL8279857 0.86 CYSLTR2 (0.54) LTA4HMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 LOXL2 4346/4885LTA4H 1742/4885KDM4E 1574/4885

“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.