SCHEMBL25855862

SCHEMBL25855862

C=C(C)C(=O)Oc1ccc(-c2ccc3c(c2)sc2c(C(F)(F)F)c(OC(=O)C(=C)C)ccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
ATM Q13315 1/20 0.36
ELANE P08246 1/20 0.36
LIMK1 P53667 3/20 0.33
ESR1 P03372 3/20 0.33
KIF11 P52732 1/20 0.32
RXRA P19793 2/20 0.31
RXRB P28702 2/20 0.31
RXRG P48443 2/20 0.31
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL25853240 0.91 ELANE (0.36) KMT2AATMELANE
SCHEMBL25854769 0.86 KMT2A (0.38) KMT2AATMELANELIMK1ESR1
SCHEMBL25856162 0.85 KMT2A (0.35) KMT2AATMELANELIMK1ESR1
SCHEMBL25854662 0.85 ELANE (0.36) KMT2AATMELANEESR1
SCHEMBL25856101 0.85 ELANE (0.37) KMT2AATMELANEKIF11
SCHEMBL25867985 0.85 ESR1 (0.33) KMT2AATMELANEESR1LMNA
SCHEMBL25855040 0.84 KMT2A (0.39) KMT2AATMELANELIMK1ESR1
SCHEMBL25855861 0.84 ESR1 (0.34) LIMK1ESR1KIF11
SCHEMBL25855449 0.83 TUBB4A (0.39) KMT2AATMELANELIMK1ESR1
SCHEMBL25853994 0.83 ELANE (0.34) KMT2AATMELANE

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
WO-2023134598-A1 POLYMERISABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed
WO-2023134596-A1 NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed