SCHEMBL31056825

SCHEMBL31056825

Cc1cc(OCc2ccccc2)c(C2OCCO2)cc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.47
RXRA P19793 3/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
PTGER1 P34995 2/20 0.45
FOLH1 Q04609 1/20 0.45
FFAR4 Q5NUL3 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
EDNRA P25101 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
DHODH Q02127 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CTSV O60911 1/20 0.41
CTSL P07711 1/20 0.41

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
Lithium Ion SCHEMBL31056412 0.91 RXRA (0.42) MCL1RXRARXRBRXRGPTGER1
SCHEMBL31056326 0.90 RAB9A (0.44) MCL1RXRARXRBRXRGFFAR4
SCHEMBL31056217 0.85 FOLH1 (0.48) MCL1PTGER1FOLH1L3MBTL1KDM4E
SCHEMBL31056045 0.85 PTGER1 (0.50) MCL1RXRARXRBPTGER1FOLH1
SCHEMBL31056459 0.85 FOLH1 (0.45) MCL1RXRARXRBRXRGPTGER1
SCHEMBL31056250 0.82 PTGER1 (0.48) RXRARXRBRXRGPTGER1POLB
SCHEMBL31056247 0.82 FOLH1 (0.43) MCL1PTGER1FOLH1L3MBTL1KDM4E
SCHEMBL3112448 0.81 RXRA (0.59) MCL1RXRARXRBRXRGPTGER1
SCHEMBL31056705 0.81 PTGER1 (0.40) MCL1PTGER1FOLH1L3MBTL1EDNRA
SCHEMBL31056266 0.81 HTR2C (0.46) FFAR4L3MBTL1MAPTCYP2C19SMN1; SMN2

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-2024178390-A1 COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2024-08-29 WO disclosed