SCHEMBL15021985

SCHEMBL15021985

O=C(O)NCCc1ncc(-c2ccc(NC(=O)Nc3cc(F)c(F)cc3F)cc2)s1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 10/20 0.59
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
NTRK1 P04629 1/20 0.42
CNR1 P21554 1/20 0.40
KDR P35968 4/20 0.39
NAMPT P43490 2/20 0.38
PDGFRB P09619 2/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL163752 0.88 DGAT1 (0.58) DGAT1CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL163660 0.87 DGAT1 (0.57) DGAT1CA12CA1CA2CA9
SCHEMBL15022138 0.87 DGAT1 (0.57) DGAT1CNR1KDRNAMPT
SCHEMBL15022135 0.84 DGAT1 (0.53) DGAT1CA12CA1CA2CA9
SCHEMBL158731 0.83 DGAT1 (0.54) DGAT1CA12CA1CA2CA9
SCHEMBL12503659 0.82 DGAT1 (0.53) DGAT1CA12CA1CA2CA9
SCHEMBL15022045 0.82 DGAT1 (0.60) DGAT1CNR1KDRNPC1MAPT
SCHEMBL159242 0.80 DGAT1 (0.51) DGAT1CA12CA1CA2CA9
SCHEMBL15022044 0.78 DGAT1 (0.52) DGAT1CA12CA1CA2CA9
SCHEMBL162644 0.76 DGAT1 (0.47) DGAT1CA12CA1CA2CA9

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-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US claimed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 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-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 DGAT1 1/4885CA12 4307/4885CA1 3328/4885

“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.