SCHEMBL3367284

SCHEMBL3367284

COc1ccc(OC)c(CC(=O)N2CCCC2c2nnc(-c3ccncc3)o2)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 12/20 0.52
HCRTR2 O43614 12/20 0.52
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL3370560 0.86 HCRTR1 (0.47) HCRTR1HCRTR2ALDH1A1MEN1KMT2A
SCHEMBL3367463 0.83 HCRTR1 (0.63) HCRTR1HCRTR2
SCHEMBL3370569 0.78 HCRTR1 (0.47) HCRTR1HCRTR2
SCHEMBL3370196 0.78 HCRTR1 (0.56) HCRTR1HCRTR2ALDH1A1
SCHEMBL3369115 0.78 HCRTR1 (0.52) HCRTR1HCRTR2
SCHEMBL3370363 0.78 HCRTR1 (0.53) HCRTR1HCRTR2
SCHEMBL3365251 0.77 HCRTR1 (0.48) HCRTR1HCRTR2ALDH1A1MEN1KMT2A
SCHEMBL3366771 0.76 CPT1A (0.53) HCRTR1HCRTR2RAB9AALDH1A1POLB
SCHEMBL3366910 0.76 CYP2C19 (0.49) HCRTR1HCRTR2ALDH1A1KDM4E
SCHEMBL3367532 0.75 HCRTR1 (0.47) HCRTR1HCRTR2RAB9AALDH1A1MEN1

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
EP-1532141-B1 2-PYRROLIDIN-2-YL- [1,3,4]-OXADIAZOLE DERIVATIVES AND THE USE OF THE SAME AS ANTIDEPRESSANTS GRUENENTHAL GMBH (DE) 2010-10-13 EP disclosed
US-7105538-B2 2-pyrrolidin-2-yl-[1,3,4]-oxadiazole compounds and their use as anti-depressants GRUENENTHAL GMBH (DE) 2006-09-12 US disclosed
US-20050187260-A1 2-Pyrrolidin-2-yl-[1,3,4]-oxadiazole compounds and their use as anti-depressants GRUENENTHAL GMBH (DE) 2005-08-25 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-20050187260-A1 2-Pyrrolidin-2-yl-[1,3,4]-oxadiazole compounds and their use as anti-depressants OPRD1, OPRK1, GRIN2C HCRTR1 461/4885HCRTR2 146/4885RAB9A 3699/4885

“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.