SCHEMBL29319745

SCHEMBL29319745

Cc1cccc(-c2cc(O)cc(O)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.59
ABCB1 P08183 3/20 0.59
BCR P11274 3/20 0.59
ACHE P22303 2/20 0.56
HSD17B1 P14061 4/20 0.50
HSD17B2 P37059 4/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
AKR1C2 P52895 1/20 0.49
AKR1C1 Q04828 1/20 0.49
DHODH Q02127 1/20 0.46
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
KMT2A Q03164 1/20 0.44
QPCT Q16769 1/20 0.44
PTPN5 P54829 1/20 0.43

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
SCHEMBL18736378 0.98 ABL1 (0.63) ABL1ABCB1BCRACHEHSD17B1
SCHEMBL25014571 0.93 ABL1 (0.57) ABL1ABCB1BCRACHEHSD17B1
SCHEMBL29319688 0.93 ACHE (0.60) ABL1ABCB1BCRACHEHSD17B1
SCHEMBL25014572 0.93 ABL1 (0.57) ABL1ABCB1BCRACHEHSD17B1
SCHEMBL30545101 0.88 ACHE (0.73) ACHEHSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL1029701 0.88 ACHE (0.73) ACHEHSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL8264985 0.86 ESR2 (0.48) ABL1ABCB1BCRACHEHSD17B1
SCHEMBL26135069 0.84 HSD17B1 (0.60) ABL1ABCB1BCRACHEHSD17B1
SCHEMBL30443064 0.83 ACHE (0.61) ACHECYP3A4CYP2C9AKR1C2AKR1C1
SCHEMBL28043529 0.83 ACHE (0.61) ACHECYP3A4CYP2C9AKR1C2AKR1C1

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