SCHEMBL25933478

SCHEMBL25933478

O=COc1ccc(C(c2ccc(C(=O)O)cc2)(C(F)(F)F)C(F)(F)F)cc1CC(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.39
RXRB P28702 5/20 0.39
RXRG P48443 5/20 0.39
SRD5A2 P31213 4/20 0.37
ALDH1A1 P00352 1/20 0.35
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 1/20 0.34
MRGPRX4 Q96LA9 4/20 0.33
PLA2G2D Q9UNK4 1/20 0.33
NR4A2 P43354 1/20 0.33
HNF4A P41235 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL25933475 0.82 MRGPRX4 (0.43) RXRARXRBRXRGSRD5A2ALDH1A1
SCHEMBL25933611 0.81 SRD5A2 (0.41) RXRARXRBRXRGSRD5A2ALDH1A1
SCHEMBL25933480 0.79 RXRA (0.43) RXRARXRBRXRGSRD5A2RARA
SCHEMBL17084443 0.76 SRD5A2 (0.46) RXRARXRBRXRGSRD5A2ALDH1A1
SCHEMBL336470 0.73 SRD5A2 (0.61) RXRARXRBRXRGSRD5A2ALDH1A1
Hydrochloric Acid SCHEMBL19837805 0.72 SRD5A2 (0.59) RXRARXRBRXRGSRD5A2ALDH1A1
Hydrochloric Acid SCHEMBL8505603 0.72 SRD5A2 (0.59) RXRARXRBRXRGSRD5A2ALDH1A1
SCHEMBL16522345 0.70 ALDH1A1 (0.43) ALDH1A1MRGPRX4
SCHEMBL9290961 0.69 SRD5A2 (0.55) RXRARXRBRXRGSRD5A2
SCHEMBL9742053 0.69 RXRA (0.59) RXRARXRBRXRGSRD5A2

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-20230244148-A1 EUV RESIST UNDERLAYER FILM-FORMING COMPOSITION NISSAN CHEMICAL CORPORATION (JP) 2023-08-03 US disclosed