SCHEMBL357539

SCHEMBL357539

NC1CCN(C(=O)c2cccs2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.68
▸ ALDH1A1 P00352 7/20 0.63
▸ MAPT P10636 3/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ NPC1 O15118 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ PABPC1 P11940 1/20 0.59
▸ EIF4H Q15056 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.58
▸ THRB P10828 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ LMNA P02545 1/20 0.57
▸ ALOX12 P18054 1/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.56
▸ ABL1 P00519 1/20 0.55
▸ RIN1 Q13671 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ HSD17B10 Q99714 2/20 0.55
▸ CA12 O43570 1/20 0.55
▸ CA1 P00915 1/20 0.55

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
SCHEMBL14275545 0.91 SMN1; SMN2 (0.64) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL9001940 0.85 GAA (0.70) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL11293119 0.84 GAA (0.85) GAAALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL31668470 0.84 GAA (0.68) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL15070498 0.84 GAA (0.68) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL7301613 0.83 ALDH1A1 (0.74) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL2666138 0.81 GAA (1.00) GAAALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL23777007 0.80 GAA (0.62) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL14145255 0.80 L3MBTL1 (0.72) GAAALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL14019248 0.80 GAA (0.62) GAAALDH1A1MAPTSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2592933-B1 MIF INHIBITORS AND THEIR USES GAWECO ANDERSON (US) 2017-04-05 — — EP disclosed
EP-2592933-B1 MIF INHIBITORS AND THEIR USES GAWECO ANDERSON (US) 2017-04-05 — — EP disclosed
US-9050334-B2 MIF inhibitors and their uses INNOV88 LLC (US) 2015-06-09 — — US disclosed
US-9050334-B2 MIF inhibitors and their uses INNOV88 LLC (US) 2015-06-09 — — US disclosed
US-9050334-B2 MIF inhibitors and their uses INNOV88 LLC (US) 2015-06-09 — — US disclosed
EP-2592933-A1 MIF INHIBITORS AND THEIR USES Gaweco, Anderson (US) 2013-05-22 — — EP disclosed
US-20120035150-A1 MIF INHIBITORS AND THEIR USES INNOV88 LLC 2012-02-09 — — US disclosed
US-20120035150-A1 MIF INHIBITORS AND THEIR USES INNOV88 LLC 2012-02-09 — — US disclosed
US-20120035150-A1 MIF INHIBITORS AND THEIR USES INNOV88 LLC 2012-02-09 — — US disclosed
WO-2012009649-A1 MIF INHIBITORS AND THEIR USES GAWECO ANDERSON (US) 2012-01-19 — — WO disclosed
WO-2012009649-A1 MIF INHIBITORS AND THEIR USES GAWECO ANDERSON (US) 2012-01-19 — — 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-20120035150-A1 MIF INHIBITORS AND THEIR USES MIF, SERPINB1, HMGB2 GAA 1974/4885ALDH1A1 790/4885MAPT 3074/4885

“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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