SCHEMBL3370219

SCHEMBL3370219

O=S(=O)(Cc1ccc(Cl)cc1)N1CCCC1c1nnc(-c2ccc(-c3ccccc3)cc2)o1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
HPGD P15428 4/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 3/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
USP30 Q70CQ3 1/20 0.45
POLB P06746 1/20 0.44
CYP2D6 P10635 1/20 0.44
ALOX15B O15296 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
FKBP1A P62942 1/20 0.42
DPP4 P27487 1/20 0.41
HSD11B1 P28845 1/20 0.40

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
SCHEMBL3366848 0.95 ALDH1A1 (0.48) KDM4EHPGDALDH1A1MAPTCYP3A4
SCHEMBL3370504 0.89 CYP2C19 (0.43) KDM4EHPGDALDH1A1MAPTCYP3A4
SCHEMBL3370139 0.89 USP30 (0.43) KDM4EHPGDALDH1A1MAPTCYP3A4
SCHEMBL3366814 0.85 KDM4E (0.41) KDM4EHPGDALDH1A1MAPTCYP3A4
SCHEMBL3366972 0.85 USP30 (0.41) KDM4EHPGDALDH1A1MAPTCYP3A4
SCHEMBL3368142 0.85 CYP2C19 (0.44) KDM4EHPGDALDH1A1CYP2C19USP30
SCHEMBL3364395 0.82 ALDH1A1 (0.49) ALDH1A1CYP3A4CYP2C19USP30SMN1; SMN2
SCHEMBL3367261 0.79 SMN1; SMN2 (0.41) KDM4EHPGDALDH1A1MAPTCYP3A4
SCHEMBL3367339 0.79 CYP2C19 (0.43) KDM4EALDH1A1MAPTCYP2C19USP30
SCHEMBL3369442 0.78 ALDH1A1 (0.44) KDM4EALDH1A1MAPTUSP30POLB

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 KDM4E 1219/4885HPGD 292/4885ALDH1A1 510/4885

“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.