SCHEMBL24858703

SCHEMBL24858703

C=COC(=O)CCc1ccc(C(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.46
EPHX2 P34913 1/20 0.46
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
CYP2C19 P33261 1/20 0.43
ESRRG P62508 6/20 0.42
SLC13A5 Q86YT5 2/20 0.42
ESRRB O95718 2/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
LMNA P02545 2/20 0.40
GPR84 Q9NQS5 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NR4A2 P43354 1/20 0.39

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
SCHEMBL2008590 0.80 NR1H4 (0.54) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL5791547 0.79 ESRRG (0.40) NR1H4EPHX2RXRARXRBESRRG
SCHEMBL19506909 0.79 FFAR1 (0.53) CYP4F2CYP4A11
SCHEMBL29059726 0.79 NR1H4 (0.49) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL347597 0.78 TDP1 (0.61) TRPV1MAPTSMN1; SMN2
SCHEMBL4888029 0.78 CYP4F2 (0.68) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL2602541 0.78 CYP4F2 (0.42) CYP4F2CYP4A11LMNATRPV1
SCHEMBL19506898 0.76 THRB (0.42) SMN1; SMN2
SCHEMBL1500632 0.76 GAA (0.55) GAACYP2C19LMNAMAPTSMN1; SMN2
SCHEMBL19519435 0.76 L3MBTL1 (0.48) EPHX2GAACYP4F2CYP4A11LMNA

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-20230002520-A1 CURABLE COMPOSITION, CURED PRODUCT, AND METHOD FOR PRODUCING CURED PRODUCT TOKYO OHKA KOGYO CO., LTD. (JP) 2023-01-05 US disclosed