SCHEMBL602854

SCHEMBL602854

O=C(Nc1nnc(Cc2ccccc2)s1)c1ccc(O[C@H]2CC[C@@H](C(=O)O)CC2)c(Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 12/20 0.74
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
RXFP1 Q9HBX9 2/20 0.52
LMNA P02545 1/20 0.48

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
SCHEMBL602855 1.00 DGAT1 (0.74) DGAT1MEN1KMT2ANPC1RAB9A
Bicarbonate SCHEMBL15653364 0.90 DGAT1 (0.60) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL602099 0.90 DGAT1 (0.74) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL602100 0.90 DGAT1 (0.74) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL601025 0.85 DGAT1 (1.00) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL601024 0.85 DGAT1 (1.00) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL603741 0.85 DGAT1 (1.00) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL603208 0.82 DGAT1 (1.00) DGAT1MEN1KMT2ANPC1RAB9A
SCHEMBL603209 0.82 DGAT1 (1.00) DGAT1MEN1KMT2ANPC1RAB9A
Bicarbonate SCHEMBL15655331 0.80 DGAT1 (0.60) DGAT1MEN1KMT2ANPC1RAB9A

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 3495/4885MEN1 1432/4885KMT2A 4146/4885

“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.