SCHEMBL31056124

SCHEMBL31056124

Cc1cc(OCc2ccccc2)c(C=O)cc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
RAB9A P51151 2/20 0.46
CCNB2 O95067 1/20 0.46
CDK1 P06493 1/20 0.46
CDK4 P11802 1/20 0.46
CCNB1 P14635 1/20 0.46
CCND1 P24385 1/20 0.46
CCNB3 Q8WWL7 1/20 0.46
ERN1 O75460 2/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
USP2 O75604 1/20 0.44
PTPN1 P18031 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL24252546 0.94 MAPT (0.53) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL590803 0.89 SMN1; SMN2 (0.50) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL1539204 0.87 SMN1; SMN2 (0.52) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL7078292 0.84 ERN1 (0.56) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL31056363 0.84 SMN1; SMN2 (0.47) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL26087192 0.83 ERN1 (0.47) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL187045 0.83 MAPT (0.60) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL24983810 0.82 MAPT (0.51) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL20139379 0.82 PTPN1 (0.61) MAPTL3MBTL1SMN1; SMN2LMNAHPGD
SCHEMBL3603467 0.81 PTPN1 (0.50) MAPTL3MBTL1SMN1; SMN2LMNAHPGD

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