SCHEMBL29319720

SCHEMBL29319720

Oc1cc(O)cc(-c2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.53
ABCB1 P08183 1/20 0.53
BCR P11274 1/20 0.53
KIF11 P52732 1/20 0.49
MAOB P27338 1/20 0.47
MAPT P10636 1/20 0.46
CNR2 P34972 1/20 0.46
KDM1A O60341 1/20 0.46
CES2 O00748 1/20 0.46
MGLL Q99685 1/20 0.46
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
HSD17B1 P14061 1/20 0.45
HSD17B2 P37059 1/20 0.45
IDO1 P14902 1/20 0.45
NOTUM Q6P988 1/20 0.45
PTPN1 P18031 2/20 0.44
PTPN5 P54829 1/20 0.44

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
SCHEMBL1029849 0.90 HSD17B1 (0.58) KIF11MAOBMAPTCNR2KDM1A
SCHEMBL16562958 0.88 PTPN5 (0.49) ABL1ABCB1BCRKIF11MAOB
SCHEMBL29678302 0.85 TSHR (0.58) KIF11MAOBKDM1ACES2MGLL
SCHEMBL1263144 0.85 TSHR (0.58) KIF11MAOBKDM1ACES2MGLL
SCHEMBL322980 0.84 KIF11 (0.63) ABL1ABCB1BCRKIF11MAOB
Ammonia Solution, Strong SCHEMBL20472961 0.83 MAOB (0.56) KIF11MAOBKDM1ACES2MGLL
SCHEMBL29319988 0.81 RXRA (0.48) ABL1ABCB1BCRKIF11CNR2
SCHEMBL21945038 0.80 RXRA (0.50) MAOBMAPTMAPK1PTPN1PTPN6
SCHEMBL17204158 0.80 KIF11 (0.54) ABL1ABCB1BCRKIF11CNR2
SCHEMBL26821702 0.79 MAOB (0.59) KIF11MAOBKDM1ATSHRMAPK1

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