SCHEMBL14571749

SCHEMBL14571749

C=CC(=O)Oc1ccc(-c2ncc(OCCCCCCCCC)cn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 3/20 0.54
▸ RARB P10826 4/20 0.51
▸ NPC1 O15118 7/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ RAB9A P51151 4/20 0.50
▸ NFKB1 P19838 3/20 0.50
▸ NFKB2 Q00653 3/20 0.50
▸ RELA Q04206 3/20 0.50
▸ LMNA P02545 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ MAPT P10636 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ TSHR P16473 1/20 0.48

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
SCHEMBL27468814 0.87 RARB (0.62) THRBRARBNPC1SMN1; SMN2NFKB1
SCHEMBL74881 0.87 RARB (0.62) THRBRARBNPC1SMN1; SMN2NFKB1
SCHEMBL75102 0.86 THRB (0.67) THRBRARBNPC1SMN1; SMN2RAB9A
SCHEMBL76048 0.86 THRB (0.67) THRBRARBNPC1SMN1; SMN2RAB9A
SCHEMBL13446673 0.86 THRB (0.67) THRBRARBNPC1SMN1; SMN2RAB9A
SCHEMBL815928 0.85 THRB (0.69) THRBRARBNPC1SMN1; SMN2RAB9A
SCHEMBL14802207 0.84 RARB (0.52) RARBNPC1SMN1; SMN2RAB9ANFKB1
SCHEMBL9840305 0.84 RARB (0.52) RARBNPC1SMN1; SMN2RAB9ANFKB1
SCHEMBL9840452 0.84 RARB (0.52) RARBNPC1SMN1; SMN2RAB9ANFKB1
SCHEMBL9839315 0.84 RARB (0.52) RARBNPC1SMN1; SMN2RAB9ANFKB1

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-20070054195-A1 Optical recording medium, method of producing the same, and, optical recording method and optical reproducing method FUJI PHOTO FILM CO., LTD. 2007-03-08 — — US disclosed
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