SCHEMBL17115115

SCHEMBL17115115

Fc1ccc(-c2noc(N3CCNCC3)n2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.46
▸ MAPT P10636 7/20 0.46
▸ GAA P10253 1/20 0.46
▸ THRB P10828 2/20 0.43
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNA5 P30532 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ TP53 P04637 2/20 0.40
▸ ALOX5AP P20292 1/20 0.39
▸ S1PR1 P21453 1/20 0.39
▸ S1PR3 Q99500 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL25402586 0.85 HTR7 (0.46) MAPTGAAALOX5APLMNA
SCHEMBL18603141 0.83 HTR7 (0.50) TP53
SCHEMBL17100621 0.82 MAPT (0.54) MAPTGAATHRBNR1H4LMNA
SCHEMBL17115048 0.80 THRB (0.56) MAPTGAATHRBTP53MEN1
SCHEMBL30506255 0.79 MAPT (0.67) MAPTGAATHRBTP53MEN1
SCHEMBL20116597 0.79 MAPT (0.67) MAPTGAATHRBTP53MEN1
SCHEMBL17115025 0.79 ADRB1 (0.47) MAPTGAAMEN1KMT2ANR1H4
SCHEMBL17115053 0.79 FAAH (0.48) KCNH2KMT2ANR1H4
SCHEMBL25435232 0.78 MAPT (0.45) MAPTGAATHRBTP53ALOX5AP
SCHEMBL17100993 0.78 LMNA (0.47) GAATHRBS1PR1S1PR3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 KCNH2 4581/4885MAPT 3/4885GAA 310/4885
US-20200140400-A1 OXADIAZOLE COMPOUNDS OXA1L, PSEN1, MAPT KCNH2 4624/4885MAPT 3/4885GAA 426/4885
US-20170073319-A1 OXADIAZOLE COMPOUNDS OXA1L, PSEN1, MAPT KCNH2 4581/4885MAPT 3/4885GAA 310/4885

“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.

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