SCHEMBL14326160

SCHEMBL14326160

O=C1c2ccc(C#Cc3ccccc3)cc2C(=O)N1CN1C(=O)c2ccc(C#Cc3ccccc3)cc2C1=O

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 17/20 0.63
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 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
SCHEMBL84238 0.91 GRM5 (0.58) GRM5MEN1HPGDKMT2AMMP2
SCHEMBL84290 0.91 GRM5 (0.55) GRM5MAPTHPGDMMP2MMP9
SCHEMBL84480 0.89 GRM5 (0.56) GRM5MAPTRAB9ASMN1; SMN2MMP2
SCHEMBL504644 0.87 GRM5 (0.60) GRM5RAB9AMEN1KMT2AMMP2
SCHEMBL23425551 0.86 GRM5 (0.62) GRM5MAPTMEN1HPGDKMT2A
SCHEMBL16927148 0.86 GRM5 (0.66) GRM5MAPTRAB9ASMN1; SMN2
SCHEMBL83864 0.81 GRM5 (0.60) GRM5MAPTMEN1KMT2A
SCHEMBL14326433 0.81 GRM5 (0.56) GRM5
SCHEMBL26310462 0.81 GRM5 (0.54) GRM5RAB9AMEN1KMT2AMMP2
SCHEMBL7678431 0.80 ESR1 (0.58) GRM5MEN1KMT2A

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-RE43880-E1 Solvent free low-melt viscosity imide oligomers and thermosetting polymide composites THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2012-12-25 US disclosed