SCHEMBL3737255

SCHEMBL3737255

CC(C)(C)OC(=O)N1CCc2cc(C(=O)Nc3nnc(Cc4cccnc4)s3)ccc2C1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
POLB P06746 2/20 0.46
ESR2 Q92731 1/20 0.45
RXFP1 Q9HBX9 2/20 0.43
GLA P06280 1/20 0.43
MAPK1 P28482 1/20 0.43
NOD2 Q9HC29 1/20 0.43
GLS O94925 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GRAMD1A Q96CP6 1/20 0.42
HCRTR2 O43614 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NOX1 Q9Y5S8 1/20 0.41
RPS6KA2 Q15349 1/20 0.41

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
SCHEMBL3740010 0.91 RXFP1 (0.53) LMNAMEN1KMT2APOLBESR2
SCHEMBL3738387 0.88 DGAT1 (0.49) LMNAMEN1KMT2APOLBESR2
SCHEMBL3725769 0.87 RXFP1 (0.49) LMNAMEN1KMT2AESR2RXFP1
SCHEMBL3733735 0.86 ESR2 (0.47) LMNAMEN1KMT2AESR2RXFP1
SCHEMBL3730968 0.86 L3MBTL1 (0.51) LMNAMEN1KMT2APOLBESR2
SCHEMBL3729472 0.86 SCD (0.56) LMNAMEN1KMT2AESR2RXFP1
SCHEMBL3727599 0.86 RXFP1 (0.47) LMNAMEN1KMT2AESR2RXFP1
SCHEMBL3725773 0.86 ESR2 (0.46) LMNAMEN1KMT2AESR2RXFP1
SCHEMBL3730980 0.85 NPC1 (0.53) LMNAMEN1KMT2APOLBESR2
SCHEMBL3728160 0.85 ESR2 (0.46) LMNAMEN1KMT2AESR2RXFP1

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-20100120669-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE BOUILLOT ANNE MARIE JEANNE 2010-05-13 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-20100120669-A1 THIADIAZOLE DERIVATIVES, INHIBITORS OF STEAROYL-COA DESATURASE SCD, SCD5, FADS2 LMNA 2761/4885MEN1 4844/4885KMT2A 3443/4885

“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.