SCHEMBL601362

SCHEMBL601362

O=C(Nc1nnc(CCC2CCCC2)s1)c1ccc(OC2CCC(C(=O)O)CC2)cc1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 16/20 0.75
GLS O94925 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 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
SCHEMBL601361 1.00 DGAT1 (0.75) DGAT1GLSSMN1; SMN2NPC1RAB9A
Bicarbonate SCHEMBL15655650 0.91 DGAT1 (0.65) DGAT1GLSSMN1; SMN2NPC1RAB9A
SCHEMBL601432 0.86 DGAT1 (1.00) DGAT1GLSSMN1; SMN2NPC1RAB9A
SCHEMBL603963 0.86 DGAT1 (1.00) DGAT1GLSSMN1; SMN2NPC1RAB9A
SCHEMBL603170 0.84 DGAT1 (0.75) DGAT1GLSSMN1; SMN2NPC1RAB9A
SCHEMBL603169 0.84 DGAT1 (0.75) DGAT1GLSSMN1; SMN2NPC1RAB9A
SCHEMBL601327 0.83 DGAT1 (0.58) DGAT1SMN1; SMN2
SCHEMBL601328 0.83 DGAT1 (0.58) DGAT1SMN1; SMN2
SCHEMBL601329 0.83 DGAT1 (0.58) DGAT1SMN1; SMN2
SCHEMBL601024 0.83 DGAT1 (1.00) DGAT1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2391611-B1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-04-30 EP claimed
US-8546391-B2 Thiadiazole and oxadiazole derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-10-01 US claimed
US-20120040984-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-02-16 US claimed
US-8546391-B2 Thiadiazole and oxadiazole derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-10-01 US disclosed
US-20120040984-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-02-16 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-20120040984-A1 THIADIAZOLE AND OXADIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF OXA1L, CYP11B2, CYP11B1 DGAT1 3495/4885GLS 181/4885SMN1; SMN2 2115/4885

“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.