SCHEMBL24022972

SCHEMBL24022972

CC1C=Cc2cccc(-c3ccc(N)cc3)c2C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.37
MAOB P27338 1/20 0.37
HTR1A P08908 5/20 0.33
HTR7 P34969 5/20 0.33
KIT P10721 2/20 0.32
KDR P35968 2/20 0.32
FLT3 P36888 2/20 0.32
HTR6 P50406 2/20 0.32
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
PRKCZ Q05513 1/20 0.30

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
SCHEMBL25515946 0.81 MAOA (0.36) MAOAHTR1AHTR7
SCHEMBL20751756 0.77 CD44 (0.33)
SCHEMBL24154513 0.72 HTR1A (0.34) HTR1AHTR7
SCHEMBL22147146 0.72 L3MBTL1 (0.34) HTR1AHTR7
SCHEMBL24772403 0.71 ENPP3 (0.34) HTR1AHTR7
SCHEMBL27462240 0.69 HTR1A (0.42) HTR1AHTR7HTR6
SCHEMBL5952789 0.69 ACHE (0.58) MAOAMAOBKITKDRFLT3
SCHEMBL27479194 0.68 HTR1A (0.41) HTR1AHTR7HTR6
SCHEMBL27477090 0.68 HTR1A (0.41) HTR1AHTR7HTR6
SCHEMBL28465360 0.67 CREBBP (0.43)

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-3174121-B1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2021-11-17 EP disclosed