SCHEMBL24099564

SCHEMBL24099564

Cc1ccc(Oc2cc(C)ccc2F)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A3 Q01959 2/20 0.45
HTR1A P08908 1/20 0.44
TEAD4 Q15561 1/20 0.43
HTR2A P28223 5/20 0.42
KCNH2 Q12809 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
AR P10275 2/20 0.41
LMNA P02545 2/20 0.41
ACHE P22303 2/20 0.40
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NFE2L2 Q16236 1/20 0.38

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
SCHEMBL11048069 0.92 SLC6A4 (0.54) SLC6A4SLC6A2SLC6A3HTR1AHTR2A
SCHEMBL11045858 0.89 ALDH1A1 (0.41) SLC6A4SLC6A2SLC6A3HTR1AHTR2A
SCHEMBL22874622 0.89 TEAD4 (0.57) SLC6A4SLC6A2SLC6A3HTR1ATEAD4
SCHEMBL22874627 0.88 LMNA (0.48) SLC6A4SLC6A2SLC6A3HTR1ATEAD4
SCHEMBL2537380 0.88 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3HTR1AHTR2A
SCHEMBL22874539 0.86 MAPT (0.40) SLC6A4SLC6A2SLC6A3HTR1AHTR2A
SCHEMBL10548072 0.85 SLC6A4 (0.39) SLC6A4SLC6A2SLC6A3HTR1ATEAD4
SCHEMBL18615345 0.84 AR (0.55) SLC6A4SLC6A2SLC6A3HTR1AALDH1A1
SCHEMBL22199022 0.83 HSPB1 (0.45) SLC6A4SLC6A2SLC6A3HTR1ATEAD4
SCHEMBL25906312 0.82 TSHR (0.45) SLC6A4TEAD4HTR2AKCNH2TDP1

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
EP-3760633-B1 OXAZINO-QUINAZOLINE AND OXAZINO-QUINAZOLINE TYPE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2021-12-15 EP disclosed