SCHEMBL6327945

SCHEMBL6327945

C=C(C)C(=O)Oc1ccc(C2(c3ccc(OC(=O)C(=C)C)c(CCC)c3)c3ccccc3-c3ccccc32)cc1CCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
FPR1 P21462 3/20 0.35
ELANE P08246 2/20 0.33
PDK2 Q15119 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
OPRK1 P41145 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
POLB P06746 1/20 0.32
PPARG P37231 2/20 0.31
PPARA Q07869 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL15356194 0.93 THRA (0.38) ESR1ESR2FPR1ELANEPDK2
SCHEMBL4953546 0.92 ESR1 (0.42) ESR1ESR2FPR1ELANEPDK2
SCHEMBL15356192 0.88 ELANE (0.39) ESR1ESR2FPR1ELANEPDK2
SCHEMBL6321833 0.88 PPARG (0.36) ESR1ESR2THRBPPARGPPARA
SCHEMBL6324789 0.88 ESR1 (0.36) ESR1ESR2FPR1PDK2PPARG
SCHEMBL18531245 0.87 ELANE (0.43) ESR1ESR2FPR1ELANEPDK2
SCHEMBL6322728 0.86 PPARG (0.39) ESR1ESR2POLBPPARGPPARA
SCHEMBL6322725 0.85 ESR1 (0.33) ESR1ESR2PDK2PPARGPPARA
SCHEMBL15356213 0.82 TSHR (0.37) ESR1ESR2PDK2MEN1MAPT
SCHEMBL4953713 0.82 ESR1 (0.54) ESR1ESR2ELANEPDK2MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10611869-B2 Curable composition and cured product AGC Inc. (JP) 2020-04-07 US disclosed
US-20190218325-A1 CURABLE COMPOSITION AND CURED PRODUCT AGC Inc. (JP) 2019-07-18 US disclosed
US-20050185232-A1 Volume hologram recording photosensitive composition and its use NIPPON PAINT CO., LTD. (JP) 2005-08-25 US disclosed
US-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed