SCHEMBL29319781

SCHEMBL29319781

Cc1c(F)cc(-c2cc(O)cc(O)c2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.44
ABCB1 P08183 3/20 0.44
BCR P11274 3/20 0.44
GAA P10253 1/20 0.41
BACE1 P56817 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
NQO1 P15559 1/20 0.39
VRK1 Q99986 1/20 0.38
CA1 P00915 2/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL881046 0.84 ALDH1A1 (0.45) GAABACE1HDAC1HDAC6CA1
SCHEMBL18673225 0.84 HDAC1 (0.42) TP53HDAC1HDAC6VRK1CA1
SCHEMBL13105050 0.81 ESR1 (0.56) ABL1ABCB1BCRESR1ESR2
SCHEMBL83362 0.79 NQO1 (0.56) GAANPC1TP53MAPK1HDAC1
SCHEMBL29319706 0.79 ABL1 (0.48) ABL1ABCB1BCRGAABACE1
SCHEMBL13673242 0.78 CA1 (0.67) HDAC1HDAC6VRK1CA1ALDH1A1
SCHEMBL29319710 0.78 ABL1 (0.48) ABL1ABCB1BCRGAANPC1
SCHEMBL337732 0.74 BACE1 (0.73) ABL1ABCB1BCRGAABACE1
SCHEMBL13086772 0.74 HDAC1 (0.41) TP53HDAC1HDAC6VRK1CA1
SCHEMBL29319737 0.73 ABCB1 (0.54) ABL1ABCB1BCRNPC1TP53

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239931-A1 FLUORINATED RESORCINOL AND HYDROQUINONE ANALOGS AS CURING AGENTS FOR FLUOROELASTOMERS CHEMOURS COMPANY FC, LLC, THE 2024-07-18 US disclosed
US-20240239931-A1 FLUORINATED RESORCINOL AND HYDROQUINONE ANALOGS AS CURING AGENTS FOR FLUOROELASTOMERS CHEMOURS COMPANY FC, LLC, THE 2024-07-18 US disclosed