SCHEMBL3364808

SCHEMBL3364808

C=CCCC(=O)N1CCCC1c1nnc(-c2ccccc2F)o1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 14/20 0.49
HCRTR2 O43614 13/20 0.49
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
TNKS O95271 1/20 0.42
PARP1 P09874 1/20 0.42
PARP2 Q9UGN5 1/20 0.42
DPP4 P27487 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
TSPO P30536 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39

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
SCHEMBL3366732 0.86 HCRTR1 (0.52) HCRTR1HCRTR2RAB9ANPC1TNKS
SCHEMBL3369471 0.82 HCRTR1 (0.54) HCRTR1HCRTR2RAB9ANPC1TNKS
SCHEMBL3367019 0.82 HCRTR1 (0.53) HCRTR1HCRTR2RAB9ANPC1
SCHEMBL3365147 0.82 HCRTR1 (0.49) HCRTR1HCRTR2RAB9ANPC1TNKS
SCHEMBL3370522 0.82 CPT1A (0.49) HCRTR1HCRTR2RAB9ANPC1TNKS
SCHEMBL3369944 0.80 HSD11B1 (0.50) HCRTR1HCRTR2RAB9ANPC1TNKS
SCHEMBL3367428 0.79 HCRTR1 (0.55) HCRTR1HCRTR2RAB9ANPC1
SCHEMBL3366979 0.78 HCRTR1 (0.51) HCRTR1HCRTR2RAB9ANPC1DPP4
SCHEMBL3369395 0.78 HCRTR1 (0.56) HCRTR1HCRTR2RAB9ANPC1
SCHEMBL6068831 0.78 HCRTR1 (0.49) HCRTR1HCRTR2RAB9ANPC1DPP4

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.