SCHEMBL7429333

SCHEMBL7429333

NC(=O)C(c1cc(F)cc(F)c1)N1CCC(NCC(O)C2COc3ccccc3O2)CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LTA4H P09960 10/20 0.36
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
MAPK1 P28482 1/20 0.35
NPC1 O15118 1/20 0.34
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL7434347 0.92 MAPT (0.37) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7437936 0.91 CA2 (0.34) LTA4HADRB2ADRB1ADRA1ASCN5A
SCHEMBL7439458 0.90 MAPT (0.40) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7439350 0.88 USP9X (0.33) MAPTLTA4HADRB2ADRB1ADRB3
SCHEMBL7441214 0.88 GAA (0.41) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7440244 0.88 ADRB2 (0.38) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7428130 0.87 MAPT (0.37) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7443120 0.87 LMNA (0.41) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7435907 0.87 KDM4E (0.40) MAPTLMNASMN1; SMN2NPSR1LTA4H
SCHEMBL7442146 0.86 EPHX1 (0.41) MAPTLMNASMN1; SMN2NPSR1LTA4H

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-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed