SCHEMBL17100679

SCHEMBL17100679

COc1ccc(S(=O)(=O)N2CCN(c3nc(C(F)(F)c4ccccc4)no3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.55
ALDH1A1 P00352 3/20 0.55
KMT2A Q03164 1/20 0.51
HSD11B1 P28845 3/20 0.50
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
LMNA P02545 2/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PKLR P30613 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
GBA1 P04062 5/20 0.48
MAPT P10636 2/20 0.45
HTT P42858 1/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 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
SCHEMBL17100667 0.91 HSD11B1 (0.50) PKMALDH1A1KMT2AHSD11B1TP53
SCHEMBL17100797 0.90 HSD11B1 (0.49) PKMALDH1A1KMT2AHSD11B1POLB
SCHEMBL17100776 0.89 ALDH1A1 (0.56) PKMALDH1A1KMT2AHSD11B1TP53
SCHEMBL17100810 0.89 GBA1 (0.41) PKMALDH1A1KMT2AHSD11B1LMNA
SCHEMBL17100799 0.86 TSHR (0.44) PKMALDH1A1KMT2AHSD11B1LMNA
SCHEMBL17100773 0.84 HSD11B1 (0.58) PKMALDH1A1KMT2AHSD11B1TP53
SCHEMBL17100813 0.82 HSD11B1 (0.53) PKMALDH1A1KMT2AHSD11B1TP53
SCHEMBL21905656 0.81 MAPT (0.42) ALDH1A1KMT2ATP53POLBLMNA
SCHEMBL17100902 0.81 PKM (0.49) PKMALDH1A1KMT2AHSD11B1TP53
SCHEMBL17100626 0.81 GBA1 (0.63) PKMALDH1A1KMT2AHSD11B1TP53

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200140400-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2020-05-07 US claimed
US-10562869-B2 Oxadiazole compounds REMYND NV (BE) 2020-02-18 US claimed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US claimed
EP-3119774-A1 OXADIAZOLE COMPOUNDS reMynd NV (BE) 2017-01-25 EP claimed
WO-2015140130-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2015-09-24 WO claimed
US-20200140400-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2020-05-07 US disclosed
US-20200140400-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2020-05-07 US disclosed
US-10562869-B2 Oxadiazole compounds REMYND NV (BE) 2020-02-18 US disclosed
US-10562869-B2 Oxadiazole compounds REMYND NV (BE) 2020-02-18 US disclosed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US disclosed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US disclosed
US-20170073319-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2017-03-16 US disclosed
EP-3119774-A1 OXADIAZOLE COMPOUNDS reMynd NV (BE) 2017-01-25 EP disclosed
WO-2015140130-A1 OXADIAZOLE COMPOUNDS REMYND NV (BE) 2015-09-24 WO 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 (3 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-10562869-B2 Oxadiazole compounds OXA1L, PSEN1, MAPT PKM 362/4885ALDH1A1 482/4885KMT2A 4820/4885
US-20200140400-A1 OXADIAZOLE COMPOUNDS OXA1L, PSEN1, MAPT PKM 354/4885ALDH1A1 561/4885KMT2A 4819/4885
US-20170073319-A1 OXADIAZOLE COMPOUNDS OXA1L, PSEN1, MAPT PKM 362/4885ALDH1A1 482/4885KMT2A 4820/4885

“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.