SCHEMBL3369372

SCHEMBL3369372

O=C(c1ccco1)N1CCCC1c1nnc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.51
HCRTR1 O43613 10/20 0.49
HCRTR2 O43614 9/20 0.49
POLB P06746 1/20 0.48
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALOX15B O15296 1/20 0.46
GAA P10253 1/20 0.44

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
SCHEMBL3366247 0.91 HCRTR1 (0.58) HSD11B1HCRTR1HCRTR2ALDH1A1TSHR
SCHEMBL3366195 0.82 HCRTR1 (0.56) HSD11B1HCRTR1HCRTR2ALDH1A1TSHR
SCHEMBL3366720 0.81 HCRTR1 (0.65) HCRTR1HCRTR2ALDH1A1SMN1; SMN2
SCHEMBL3368060 0.81 ALDH1A1 (0.46) HCRTR1HCRTR2ALDH1A1MAPTLMNA
SCHEMBL3368240 0.81 HCRTR1 (0.55) HSD11B1HCRTR1HCRTR2ALDH1A1SMN1; SMN2
SCHEMBL3366813 0.81 HCRTR1 (0.53) HCRTR1HCRTR2ALDH1A1
SCHEMBL3369802 0.81 HCRTR1 (0.52) HSD11B1HCRTR1HCRTR2ALDH1A1ALOX15B
SCHEMBL3366564 0.80 HSD11B1 (0.51) HSD11B1HCRTR1HCRTR2ALDH1A1SMN1; SMN2
SCHEMBL3370658 0.80 HSD11B1 (0.49) HSD11B1HCRTR1HCRTR2ALDH1A1SMN1; SMN2
SCHEMBL3366081 0.79 HCRTR1 (0.53) HSD11B1HCRTR1HCRTR2ALDH1A1LMNA

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 HSD11B1 545/4885HCRTR1 461/4885HCRTR2 146/4885

“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.