SCHEMBL9878294

SCHEMBL9878294

C=CCOc1ccc(OC(=O)c2ccc(-c3ccc(CCC(C)CC)cc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.44
▸ THRB P10828 4/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ ADRB3 P13945 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ PPARD Q03181 5/20 0.39
▸ PPARA Q07869 5/20 0.39
▸ PPARG P37231 4/20 0.39
▸ CYP2D6 P10635 1/20 0.38
▸ CHRNB2 P17787 1/20 0.37
▸ CHRNB4 P30926 1/20 0.37
▸ CHRNA3 P32297 1/20 0.37
▸ CHRNA4 P43681 1/20 0.37

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
SCHEMBL9878292 1.00 MAPT (0.44) MAPTTHRBSMN1; SMN2ADRB2ADRB1
SCHEMBL9878776 0.89 MAPT (0.47) MAPTTHRBSMN1; SMN2NPC1TP53
SCHEMBL9878773 0.89 MAPT (0.47) MAPTTHRBSMN1; SMN2NPC1TP53
SCHEMBL12225731 0.89 PPARD (0.47) MAPTTHRBSMN1; SMN2ADRB2ADRB1
SCHEMBL9878245 0.89 PPARD (0.47) MAPTTHRBSMN1; SMN2ADRB2ADRB1
SCHEMBL9878246 0.89 PPARD (0.47) MAPTTHRBSMN1; SMN2ADRB2ADRB1
SCHEMBL9878481 0.89 ALDH1A1 (0.47) MAPTTHRBSMN1; SMN2NPC1TP53
SCHEMBL9878486 0.89 ALDH1A1 (0.47) MAPTTHRBSMN1; SMN2NPC1TP53
SCHEMBL9879147 0.88 MAPT (0.45) MAPTTHRBSMN1; SMN2NPC1POLB
SCHEMBL9879143 0.88 MAPT (0.45) MAPTTHRBSMN1; SMN2NPC1POLB

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-5013476-A Ferroelectric properties, electro-optical indicating device HOFFMANN-LA ROCHE INC. (US) 1991-05-07 — — US disclosed
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