SCHEMBL30768356

SCHEMBL30768356

COc1cc(Oc2ccc(C(F)(F)F)cc2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
RAB9A P51151 1/20 0.49
CYP1A1 P04798 3/20 0.43
CYP1B1 Q16678 3/20 0.43
MAPT P10636 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC6A4 P31645 2/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
HTR2A P28223 1/20 0.40
KCNH2 Q12809 1/20 0.40
AR P10275 2/20 0.40
PTPN7 P35236 1/20 0.39
DUSP3 P51452 1/20 0.39
LMNA P02545 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
SCHEMBL24749567 1.00 L3MBTL1 (0.49) L3MBTL1RAB9ACYP1A1CYP1B1MAPT
SCHEMBL935540 0.82 L3MBTL1 (0.45) L3MBTL1RAB9AMAPTNPSR1KDM4E
SCHEMBL31694831 0.82 L3MBTL1 (0.59) L3MBTL1RAB9ACYP1A1CYP1B1MAPT
SCHEMBL24749629 0.80 L3MBTL1 (0.46) L3MBTL1RAB9ACYP1A1CYP1B1MAPT
SCHEMBL16659206 0.79 SMN1; SMN2 (0.56) RAB9AMAPTMEN1KMT2AAR
SCHEMBL25355053 0.79 MAPT (0.42) L3MBTL1RAB9AMAPTNPSR1MEN1
SCHEMBL24749630 0.79 L3MBTL1 (0.68) L3MBTL1RAB9AMAPTNPSR1KDM4E
SCHEMBL30768368 0.79 L3MBTL1 (0.68) L3MBTL1RAB9AMAPTNPSR1KDM4E
SCHEMBL31009369 0.78 L3MBTL1 (0.44) L3MBTL1RAB9ACYP1A1CYP1B1MAPT
SCHEMBL24749628 0.78 L3MBTL1 (0.44) L3MBTL1RAB9ACYP1A1CYP1B1MAPT

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
CN-117500786-A TEAD inhibitors 奥赖恩公司 2024-02-02 CN disclosed