SCHEMBL21322282

SCHEMBL21322282

C=C(C)C(=O)Oc1ccc(-c2ccc(O)cc2F)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.43
ESR1 P03372 14/20 0.42
ESR2 Q92731 9/20 0.42
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40
CYP3A4 P08684 1/20 0.38
AR P10275 1/20 0.34

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
SCHEMBL9607783 0.92 ELANE (0.49) ELANEKMT2AATM
SCHEMBL14987780 0.89 APP (0.46) ELANEESR1ESR2KMT2AATM
SCHEMBL12197505 0.89 ESR1 (0.49) ELANEESR1ESR2KMT2AATM
SCHEMBL12196853 0.87 GRM2 (0.44) ELANEKMT2AATM
SCHEMBL18468434 0.86 ELANE (0.45) ELANEKMT2AATM
SCHEMBL17750815 0.85 ELANE (0.43) ELANEKMT2AATM
SCHEMBL17304967 0.85 ELANE (0.43) ELANEKMT2AATM
SCHEMBL22137647 0.85 ELANE (0.50) ELANEESR1ESR2KMT2AATM
SCHEMBL26144160 0.85 ELANE (0.43) ELANEESR1ESR2KMT2AATM
SCHEMBL21322464 0.85 ELANE (0.40) ELANEESR1ESR2KMT2AATM

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
EP-2520972-B1 Liquid crystal display device alignment film, and method for manufacturing the same SAMSUNG DISPLAY CO LTD (KR) 2019-09-04 EP disclosed