SCHEMBL23640253

SCHEMBL23640253

CC1C=CC(OCCN(C)C)=CC1C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
HTR7 P34969 3/20 0.37
HRH3 Q9Y5N1 1/20 0.36
LTA4H P09960 2/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
HTR1B P28222 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RET P07949 1/20 0.33

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
SCHEMBL24302320 0.79 HRH4 (0.35) HRH3ALDH1A1
SCHEMBL24302785 0.79 HRH4 (0.35) HRH3ALDH1A1
SCHEMBL23640164 0.79 HRH4 (0.35) HRH3ALDH1A1
SCHEMBL23640445 0.78
SCHEMBL24302321 0.78
SCHEMBL24302333 0.78 NOS3 (0.32)
SCHEMBL23639977 0.78 NOS3 (0.32)
SCHEMBL24302261 0.75 HTR1B (0.39) CHRNB2CHRNA4HTR1B
SCHEMBL23640163 0.75 HTR1B (0.39) CHRNB2CHRNA4HTR1B
SCHEMBL20180434 0.72 MAPT (0.35) MAPTHTR7HRH3LTA4HKEAP1

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-3848367-A1 TRICYCLIC COMPOUNDS ACTING ON CRBN PROTEINS Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-07-14 EP disclosed