SCHEMBL11480482

SCHEMBL11480482

O=c1oc2c(c(O)c1-c1ccc(F)cc1)CCCC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 5/20 0.36
BCL9 O00512 1/20 0.35
CTNNB1 P35222 1/20 0.35
KDM4E B2RXH2 3/20 0.35
GLA P06280 2/20 0.35
GAA P10253 2/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 1/20 0.35
MIF P14174 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ESR1 P03372 2/20 0.35
ESR2 Q92731 1/20 0.35
TSHR P16473 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL11478385 0.84 SMN1; SMN2 (0.50) POLBLMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL7381407 0.83 SMN1; SMN2 (0.49) LMNASMN1; SMN2ALDH1A1KDM4EGLA
SCHEMBL811946 0.72 BRD4 (0.37) POLBSMN1; SMN2ALDH1A1KDM4EGLA
SCHEMBL11480111 0.68 MAOB (0.68) LMNAALDH1A1KDM4EMEN1RAB9A
SCHEMBL2202541 0.63 SERPINE1 (0.42) SMN1; SMN2ALDH1A1BCL9CTNNB1KDM4E
SCHEMBL7357932 0.63 NQO1 (0.64) POLBLMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL28180641 0.63 KDM4E (0.38) POLBLMNASMN1; SMN2ALDH1A1KDM4E
SCHEMBL7354114 0.62 NQO1 (0.63) POLBSMN1; SMN2KDM4EGLAGAA
SCHEMBL7350101 0.62 NQO1 (0.63) POLBSMN1; SMN2KDM4EGLAGAA
SCHEMBL7357238 0.62 NQO1 (0.63) POLBSMN1; SMN2KDM4EGLAGAA

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-4230850-A HYPOTENSIVE AGENTS, VASODILATION LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1980-10-28 US disclosed