SCHEMBL3368901

SCHEMBL3368901

O=C(Cc1ccc(Cl)cc1)N1CCCC1c1nnc(-c2ccccc2)o1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 5/20 0.51
HCRTR2 O43614 4/20 0.51
HSD11B1 P28845 2/20 0.49
HPGD P15428 1/20 0.47
PRCP P42785 1/20 0.47
CPT1A P50416 2/20 0.45
USP30 Q70CQ3 1/20 0.44
DPP4 P27487 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ALOX15B O15296 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TNKS O95271 1/20 0.42
PARP1 P09874 1/20 0.42
PARP2 Q9UGN5 1/20 0.42
KCNH2 Q12809 1/20 0.42
MCHR1 Q99705 1/20 0.42

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
SCHEMBL3366080 0.93 HCRTR1 (0.55) HCRTR1HCRTR2HSD11B1USP30DPP4
SCHEMBL3369115 0.87 HCRTR1 (0.52) HCRTR1HCRTR2CPT1AUSP30DPP4
SCHEMBL3365286 0.85 CPT1A (0.61) HCRTR1HCRTR2HSD11B1CPT1A
SCHEMBL3366773 0.83 CPT1A (0.66) HSD11B1CPT1A
SCHEMBL3366195 0.82 HCRTR1 (0.56) HCRTR1HCRTR2HSD11B1USP30ALOX15B
SCHEMBL3369975 0.81 HSD11B1 (0.52) HCRTR1HCRTR2HSD11B1PRCPCPT1A
SCHEMBL3370370 0.81 HCRTR1 (0.60) HCRTR1HCRTR2HSD11B1USP30DPP4
SCHEMBL3370196 0.81 HCRTR1 (0.56) HCRTR1HCRTR2CPT1AUSP30ALDH1A1
SCHEMBL3370351 0.80 HSD11B1 (0.54) HCRTR1HCRTR2HSD11B1CPT1ASMN1; SMN2
SCHEMBL3366654 0.80 HSD11B1 (0.51) HCRTR1HCRTR2HSD11B1CPT1ASMN1; SMN2

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 146/4885HSD11B1 545/4885

“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.