SCHEMBL601130

SCHEMBL601130

CC(C)(C)C(C(=O)O)C1CCC(c2ccc(C(=O)Nc3nnc(Cc4ccccc4)s3)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 18/20 0.69
RXFP1 Q9HBX9 1/20 0.58
MEN1 O00255 1/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58

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
SCHEMBL601393 0.92 DGAT1 (0.70) DGAT1
SCHEMBL3671468 0.86 DGAT1 (0.80) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL602580 0.83 DGAT1 (0.78) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL603709 0.83 DGAT1 (0.78) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL3672639 0.83 DGAT1 (0.78) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL601089 0.82 DGAT1 (0.69) DGAT1RXFP1MEN1NPC1RAB9A
Bicarbonate SCHEMBL15655199 0.82 DGAT1 (0.76) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL3672844 0.82 DGAT1 (0.76) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL3673344 0.82 DGAT1 (0.76) DGAT1RXFP1MEN1NPC1RAB9A
SCHEMBL601276 0.81 DGAT1 (1.00) DGAT1MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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.