SCHEMBL601585

SCHEMBL601585

COC(=O)[C@H]1CC[C@H](Oc2ccc(C(=O)Nc3nnc(Cc4ccccc4)s3)cc2)CC1

nearest known ligand 0.84

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 12/20 0.84
RXFP1 Q9HBX9 2/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
POLB P06746 1/20 0.53

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
SCHEMBL603236 1.00 DGAT1 (0.84) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL601025 0.92 DGAT1 (1.00) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL601024 0.92 DGAT1 (1.00) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL603741 0.92 DGAT1 (1.00) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL600853 0.88 DGAT1 (0.84) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL602660 0.88 DGAT1 (0.84) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL3669423 0.88 DGAT1 (0.82) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL3676256 0.87 DGAT1 (0.80) DGAT1RXFP1MEN1KMT2ANPC1
Bicarbonate SCHEMBL15656218 0.87 DGAT1 (0.80) DGAT1RXFP1MEN1KMT2ANPC1
SCHEMBL604573 0.86 DGAT1 (0.79) DGAT1RXFP1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 3495/4885RXFP1 4408/4885MEN1 1432/4885

“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.