SCHEMBL25867987

SCHEMBL25867987

C=C(C)C(=O)Oc1ccc2c(c1)sc1c(OC(F)(F)F)c(OC(=O)CC)ccc12

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.34
KDM4E B2RXH2 2/20 0.32
GLA P06280 2/20 0.32
GAA P10253 2/20 0.32
HPGD P15428 2/20 0.32
MAPK1 P28482 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
DYRK1A Q13627 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
LMNA P02545 1/20 0.31
ELANE P08246 1/20 0.31
ALOX15 P16050 1/20 0.30
CSNK1D P48730 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
SCHEMBL25853306 0.93 DYRK1A (0.35) ESR1MAPK1KMT2ADYRK1AELANE
SCHEMBL25867926 0.88 TUBB4A (0.37) ESR1KDM4EGLAGAAHPGD
SCHEMBL25867985 0.86 ESR1 (0.33) ESR1KDM4EGLAGAAHPGD
SCHEMBL25856162 0.85 KMT2A (0.35) ESR1KMT2ADYRK1AELANE
SCHEMBL25853924 0.85 KMT2A (0.31) KDM4EGLAGAAHPGDMAPK1
SCHEMBL25867866 0.84 KMT2A (0.41) ESR1KDM4EGLAGAAHPGD
SCHEMBL25854668 0.81 ELANE (0.34) ESR1KMT2ADYRK1AELANE
SCHEMBL25854312 0.81 ELANE (0.33) KMT2AELANE
SCHEMBL25853233 0.80 TUBB4A (0.41) KDM4EGAAMAPK1KMT2AALDH1A1
SCHEMBL25853240 0.78 ELANE (0.36) MAPK1KMT2ADYRK1AALDH1A1ELANE

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
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