SCHEMBL2226449

SCHEMBL2226449

O=C(O)N1CC(=Cc2nc(-c3ccc(F)cc3)cs2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
HTT P42858 3/20 0.43
MAPK1 P28482 5/20 0.42
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 7/20 0.42
RAB9A P51151 4/20 0.42
ALOX5 P09917 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
NPC1 O15118 1/20 0.42
KMT2A Q03164 6/20 0.42
MEN1 O00255 5/20 0.42
KDM4E B2RXH2 3/20 0.41
GAA P10253 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 2/20 0.41

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
SCHEMBL6913121 0.83 SMN1; SMN2 (0.44) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL3612022 0.73 ALDH1A1 (0.49) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL3612019 0.73 ALDH1A1 (0.49) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL3650972 0.72 RAB9A (0.51) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL3650974 0.72 RAB9A (0.51) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL3765693 0.72 LMNA (0.72) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL3615585 0.72 ALDH1A1 (0.58) LMNAMAPK1MAPTSMN1; SMN2ALDH1A1
SCHEMBL17296082 0.72 ACHE (0.48) LMNAALDH1A1RAB9ANPC1
SCHEMBL3766121 0.70 TRPV1 (0.53) LMNAHTTMAPK1MAPTSMN1; SMN2
SCHEMBL2227569 0.69 RAB9A (0.48) LMNAHTTMAPK1MAPTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8981084-B2 Oxadiazole HDAC inhibitors TEMPERO PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
EP-2523664-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals, Inc. (US) 2012-11-21 EP disclosed
US-20120289495-A1 COMPOUNDS AND METHODS Tempero Pharmaceuticals Inc. 2012-11-15 US disclosed
WO-2011088192-A1 COMPOUNDS AND METHODS TEMPERO PHARMACEUTICALS, INC. (US) 2011-07-21 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 (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-20120289495-A1 COMPOUNDS AND METHODS XDH, CCNY, TOP2B LMNA 222/4885HTT 3459/4885MAPK1 4174/4885

“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.