SCHEMBL27366883

SCHEMBL27366883

Cc1ccc(N2CCC(OC3CCNCC3)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 6/20 0.61
HTR3E A5X5Y0 3/20 0.44
HTR3B O95264 3/20 0.44
HTR3A P46098 3/20 0.44
HTR3D Q70Z44 3/20 0.44
HTR3C Q8WXA8 3/20 0.44
SIGMAR1 Q99720 3/20 0.44
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GPR119 Q8TDV5 1/20 0.42
LTA4H P09960 3/20 0.38
ESRRB O95718 2/20 0.38
ESRRG P62508 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP2D6 P10635 1/20 0.37
KCNH2 Q12809 1/20 0.37
HTR7 P34969 1/20 0.37
MELK Q14680 1/20 0.37

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
SCHEMBL27364129 0.83 SCN1A (0.50) ADRB1MAPTALDH1A1GPR119MEN1
Hydrochloric Acid SCHEMBL5208875 0.80 KDM4E (0.47) GPR119
SCHEMBL6132921 0.79 ADRB1 (0.49) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL20579629 0.78 OPRD1 (0.43) MAPTALDH1A1GPR119MEN1KMT2A
SCHEMBL171731 0.78 ADRB1 (0.50) ADRB1MAPTALDH1A1GPR119MEN1
Hydrochloric Acid SCHEMBL31753304 0.77 HRH3 (0.51) MAPTALDH1A1GPR119
SCHEMBL6645952 0.77 ADRB1 (1.00) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL81940 0.77 ADRB1 (1.00) ADRB1HTR3EHTR3BHTR3AHTR3D
SCHEMBL23422562 0.75 ADRB1 (0.62) ADRB1MEN1KMT2A
SCHEMBL18311444 0.75 ADRB1 (0.68) ADRB1HTR3EHTR3BHTR3AHTR3D

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-2024054591-A1 RAPIDLY ACCELERATED FIBROSARCOMA (RAF) DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-03-14 WO disclosed