SCHEMBL6485663

SCHEMBL6485663

O=C(O)C=Cc1ccc(OCCn2c(=O)oc3ccccc32)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.61
TSHR P16473 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
ALDH1A1 P00352 5/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.57
POLB P06746 2/20 0.52
TBXAS1 P24557 2/20 0.49
KMT2A Q03164 2/20 0.48
TP53 P04637 1/20 0.48
MAPK1 P28482 2/20 0.48
LMNA P02545 2/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL6485660 1.00 RAB9A (0.61) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7023926 0.86 SIGMAR1 (0.56) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7023922 0.86 SIGMAR1 (0.56) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7019446 0.84 RAB9A (0.61) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6477010 0.83 TSHR (0.66) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7017531 0.81 ALDH1A1 (0.59) RAB9ATSHRSMN1; SMN2ALDH1A1NPSR1
SCHEMBL7017529 0.81 ALDH1A1 (0.59) RAB9ATSHRSMN1; SMN2ALDH1A1NPSR1
SCHEMBL6476905 0.79 TSHR (0.62) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6475863 0.78 L3MBTL1 (0.57) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6476872 0.78 RAB9A (0.70) RAB9ATSHRSMN1; SMN2ALDH1A1L3MBTL1

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-6919362-B2 Heterocyclic derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2005-07-19 US disclosed
US-20030040533-A1 Novel heterocyclic derivatives, preparation method and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2003-02-27 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-20030040533-A1 Novel heterocyclic derivatives, preparation method and pharmaceutical compositions containing same CYP2F1, CYP11B2, CYP4B1 RAB9A 3361/4885TSHR 844/4885SMN1; SMN2 1823/4885

“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.