SCHEMBL11570938

SCHEMBL11570938

CC(C)CCCC(C)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.60
MAPK1 P28482 1/20 0.59
KMT2A Q03164 1/20 0.59
GRIN2D O15399 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
SRD5A2 P31213 2/20 0.43
PLA2G4B P0C869 2/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL9319143 0.88 KMT2A (0.69) RARBMAPK1KMT2ACA1CA2
SCHEMBL11758882 0.87 L3MBTL1 (0.50) RARBMAPK1KMT2AGRIN2DGRIN2A
SCHEMBL8084708 0.87 KMT2A (0.59) RARBMAPK1KMT2ATP53TSHR
SCHEMBL8434202 0.87 KMT2A (0.59) RARBMAPK1KMT2ATP53TSHR
SCHEMBL8436176 0.86 TP53 (0.58) RARBMAPK1KMT2ATP53TSHR
SCHEMBL8072342 0.86 TP53 (0.58) RARBMAPK1KMT2ATP53TSHR
SCHEMBL5091731 0.84 TP53 (0.60) RARBMAPK1KMT2ATP53TSHR
SCHEMBL13953004 0.84 TP53 (0.60) RARBMAPK1KMT2ATP53TSHR
SCHEMBL7613153 0.84 RARB (0.69) RARBMAPK1KMT2ATP53TSHR
SCHEMBL4602775 0.84 TP53 (0.60) RARBMAPK1KMT2ATP53TSHR

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
US-4138579-A INSECTICIDES HOFFMANN-LA ROCHE INC. (US) 1979-02-06 US disclosed
US-4051319-A INSECTICIDES HOFFMANN-LA ROCHE INC. (US) 1977-09-27 US disclosed
US-3957833-A KILLING INSECTS, HORMONES HOFFMANN-LA ROCHE INC. (US) 1976-05-18 US disclosed