SCHEMBL3389240

SCHEMBL3389240

FCc1nc2c(c(C(F)(F)F)n1)CCNC2

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.37
HTR2C P28335 5/20 0.37
HTR2B P41595 5/20 0.37
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
Hydrochloric Acid SCHEMBL1262759 0.98 HTR2A (0.36) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL1262608 0.85 HTR2A (0.36) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
SCHEMBL3421612 0.84 DPP4 (0.36) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL1262905 0.82 DPP4 (0.36) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL1262892 0.81 HTR2A (0.34) HTR2AHTR2CHTR2B
SCHEMBL3393508 0.80 DPP4 (0.38) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL1262187 0.79 DPP4 (0.37) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
SCHEMBL1967719 0.79 HTR2A (0.34) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1
SCHEMBL3389339 0.78 HTR2C (0.61) HTR2AHTR2CHTR2B
SCHEMBL1970467 0.78 HTR2A (0.36) HTR2AHTR2CHTR2BSMN1; SMN2L3MBTL1

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
EP-1863812-B1 DIPEPTIDYL PEPTIDASE-IV INHIBITING COMPOUNDS, METHODS OF PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE AGENT LG LIFE SCIENCES LTD (KR) 2010-07-14 EP disclosed