SCHEMBL3367896

SCHEMBL3367896

COc1ccc(C(=O)N2CCCC2c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 8/20 0.62
HCRTR2 O43614 8/20 0.62
MAPT P10636 1/20 0.52
POLB P06746 1/20 0.51
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
TSHR P16473 1/20 0.48
CPT1A P50416 2/20 0.47
SCD5 Q86SK9 1/20 0.46
ALDH1A1 P00352 2/20 0.45
USP30 Q70CQ3 1/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
HIF1A Q16665 1/20 0.45

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
SCHEMBL3367335 0.98 HCRTR1 (0.61) HCRTR1HCRTR2MAPTPOLBNPC1
SCHEMBL3366901 0.92 HCRTR1 (0.61) HCRTR1HCRTR2NPC1RAB9ATSHR
SCHEMBL3366748 0.87 ALDH1A1 (0.55) HCRTR1HCRTR2MAPTNPC1RAB9A
SCHEMBL3366195 0.87 HCRTR1 (0.56) HCRTR1HCRTR2NPC1RAB9ATSHR
SCHEMBL3367538 0.85 HCRTR1 (0.53) HCRTR1HCRTR2NPC1RAB9ATSHR
SCHEMBL3367000 0.85 HCRTR1 (0.54) HCRTR1HCRTR2MAPTNPC1RAB9A
SCHEMBL3368917 0.84 HCRTR1 (0.58) HCRTR1HCRTR2NPC1RAB9ATSHR
SCHEMBL3370582 0.83 HCRTR1 (0.53) HCRTR1HCRTR2MAPTPOLBNPC1
SCHEMBL3367057 0.83 HCRTR1 (0.65) HCRTR1HCRTR2NPC1RAB9ASCD5
SCHEMBL3366784 0.83 HCRTR1 (0.65) HCRTR1HCRTR2SCD5

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 146/4885MAPT 1363/4885

“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.