SCHEMBL6666070

SCHEMBL6666070

Nc1ccc(C(c2ccc(N)c(C(F)(F)F)c2C(F)(F)F)(C(F)(F)F)C(F)(F)F)c(C(F)(F)F)c1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
GLA P06280 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL1773085 0.82 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL8174823 0.81 TSHR (0.33) SMN1; SMN2POLBGAATSHR
SCHEMBL29620304 0.81 KIF11 (0.36) SMN1; SMN2GLAPOLBGAATSHR
SCHEMBL6313808 0.81 KIF11 (0.36) SMN1; SMN2GLAPOLBGAATSHR
SCHEMBL1773087 0.74 ESR1 (0.33) GLAPOLBGAA
SCHEMBL6310762 0.73 POLB (0.37) SMN1; SMN2GLAPOLBGAATSHR
SCHEMBL13385875 0.72 TSHR (0.39) GLAPOLBGAATSHR
SCHEMBL6666165 0.70 SMN1; SMN2 (0.40) SMN1; SMN2TSHR
SCHEMBL8066356 0.70 GAA (0.34) GLAPOLBGAATSHR
SCHEMBL10451588 0.70 GLA (0.34) SMN1; SMN2GLAPOLBGAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1146063-B1 POLYIMIDE PRECURSORS AND POLYIMIDES NISSAN CHEMICAL IND LTD (JP) 2004-09-15 EP disclosed
US-6489431-B1 CONTAINS A BIVALENT ORGANIC GROUP CONSTITUTING A DIAMINE HAVING A HEXAFLUOROPROPYLIDENE GROUP IN ITS MOLECULE REPRESENTED BY THE FOLLOWING GENERAL FORMULA (2), AND THE REDUCED VISCOSITY IS FROM 0.05 TO 5.0 DL/G (IN NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-12-03 US disclosed
EP-1146063-A1 POLYIMIDE PRECURSORS AND POLYIMIDES Nissan Chemical Industries, Ltd. (JP) 2001-10-17 EP disclosed