SCHEMBL8942454

SCHEMBL8942454

Cc1cccc([O])c1C(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.35
PPARA Q07869 4/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ESR1 P03372 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
PKM P14618 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31

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
SCHEMBL8719727 0.75 ESR1 (0.50) PPARGPPARAMAPK1SMN1; SMN2ESR1
SCHEMBL8942353 0.72 LTA4H (0.36) PPARGPPARATDP1L3MBTL1MTNR1A
SCHEMBL4192650 0.70 CA1 (0.40) MAPK1ESR1TDP1CYP1A2CYP2C9
SCHEMBL11579137 0.66 SCN4A (0.41) PPARGPPARAMAPK1SMN1; SMN2L3MBTL1
SCHEMBL9453500 0.66 KDM4E (0.41) MAPK1SMN1; SMN2ESR1CYP1A2CYP2C9
SCHEMBL8651083 0.64 KCNH2 (0.44) TDP1NPC1RAB9A
SCHEMBL10744223 0.64 SMN1; SMN2 (0.48) MAPK1SMN1; SMN2TDP1NPC1RAB9A
SCHEMBL49378 0.63
SCHEMBL8717190 0.63 LMNA (0.42) PPARGPPARASMN1; SMN2NPC1RAB9A
SCHEMBL19757664 0.63 ESR1 (0.45) MAPK1SMN1; SMN2ESR1MTNR1AMTNR1B

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-5557003-A SOLVENT EXTRACTION OF ZINC FROM ORE ZENECA LIMITED (GB) 1996-09-17 US disclosed