SCHEMBL9769804

SCHEMBL9769804

CC(C)(C)c1cccc(-c2cccc(O)c2C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.55
RXRB P28702 3/20 0.55
HDAC4 P56524 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
PTPN5 P54829 2/20 0.44
KIF11 P52732 1/20 0.41
RXRG P48443 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ACHE P22303 3/20 0.40
P2RX1 P51575 1/20 0.39
CYP26A1 O43174 1/20 0.39
CYP26B1 Q9NR63 1/20 0.39

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
SCHEMBL9769821 0.88 CNR2 (0.55) RXRARXRBHDAC4HDAC2HDAC8
SCHEMBL9769811 0.86 CA12 (0.42) RXRARXRBCA12CA1CA2
SCHEMBL28378098 0.81 HDAC4 (0.51) RXRARXRBHDAC4HDAC2HDAC8
SCHEMBL27587036 0.80 PTPN5 (0.59) RXRARXRBHDAC4HDAC2HDAC8
SCHEMBL3877267 0.79 HNF4A (0.63) RXRARXRBHDAC4HDAC2HDAC8
SCHEMBL3264678 0.78 CA12 (0.64) HDAC4HDAC2HDAC8CA12CA1
SCHEMBL4368940 0.78 FOLH1 (0.60) RXRARXRBCA12CA1CA2
SCHEMBL10046425 0.76 CA12 (0.80) CA12CA1CA2CA7CA9
SCHEMBL8889619 0.76 CA12 (0.47) CA12CA1CA2CA7CA9
Biphenyl SCHEMBL5316961 0.75 KMO (0.61) RXRARXRBCA12CA1CA2

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-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed