SCHEMBL7157751

SCHEMBL7157751

COc1ccc(-c2cc(C(=O)O)cc(C(=O)O)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.68
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
NR4A2 P43354 1/20 0.60
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
TP53 P04637 1/20 0.55
MAPK1 P28482 1/20 0.55
CASP3 P42574 1/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
KDM4E B2RXH2 1/20 0.55
DHODH Q02127 1/20 0.53
ALPL P05186 1/20 0.53
CA9 Q16790 1/20 0.53
CHEK1 O14757 1/20 0.53

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
SCHEMBL16195442 0.90 RXRA (0.60) RXRACA1CA2NR4A2SMN1; SMN2
SCHEMBL2043183 0.86 CA1 (0.87) RXRACA1CA2NR4A2SMN1; SMN2
Hydrochloric Acid SCHEMBL6705880 0.84 CA1 (0.83) RXRACA1CA2NR4A2SMN1; SMN2
SCHEMBL29128751 0.84 RXRA (0.72) RXRACA1CA2NR4A2KDM4E
SCHEMBL29572748 0.84 RXRA (0.67) RXRACA1CA2NR4A2KDM4E
SCHEMBL3639698 0.84 SMN1; SMN2 (0.74) RXRACA1CA2SMN1; SMN2NPC1
SCHEMBL16488615 0.83 DHODH (0.69) RXRADHODHAURKATPX2
SCHEMBL15814719 0.83 DHODH (0.69) RXRADHODHAURKATPX2
SCHEMBL12774551 0.83 CA1 (0.66) RXRACA1CA2SMN1; SMN2NPC1
SCHEMBL3350034 0.83 HPGD (0.55) RXRACA1CA2NR4A2SMN1; SMN2

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-6541185-B1 Thin film of liquid crystal polymer and dichroism compound JAPAN CHEMICAL INNOVATION INSTITUTE (JP) 2003-04-01 US disclosed