SCHEMBL23555133

SCHEMBL23555133

CCC1CCN(c2c(C)cccc2C)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.50
▸ SLC6A4 P31645 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.45
▸ C5AR1 P21730 6/20 0.44
▸ ALDH1A1 P00352 6/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ HTT P42858 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CRHBP P24387 1/20 0.42
▸ CRHR2 Q13324 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ HTR7 P34969 1/20 0.40
▸ GAA P10253 2/20 0.40

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
SCHEMBL27307706 0.89 SLC6A2 (0.42) SLC6A2SLC6A4C5AR1ALDH1A1KMT2A
SCHEMBL22663301 0.80 FFAR4 (0.43) C5AR1
SCHEMBL20756535 0.80 ADRB1 (0.53) ALDH1A1KMT2AMEN1LMNATSHR
SCHEMBL21287875 0.79 ALDH1A1 (0.42) SLC6A2SLC6A4TDP1C5AR1ALDH1A1
SCHEMBL16882199 0.79 SLC6A2 (0.43) SLC6A2SLC6A4TDP1C5AR1ALDH1A1
SCHEMBL23554912 0.79 SLC6A2 (0.38) SLC6A2SLC6A4TDP1C5AR1ALDH1A1
SCHEMBL27306689 0.78 ALDH1A1 (0.42) SLC6A2SLC6A4TDP1C5AR1ALDH1A1
SCHEMBL1688137 0.77 SLC6A2 (0.44) SLC6A2SLC6A4TDP1C5AR1ALDH1A1
SCHEMBL9785694 0.77 ALDH1A1 (0.47) SLC6A2SLC6A4TDP1C5AR1ALDH1A1
SCHEMBL11457763 0.77 KMT2A (0.46) SLC6A2SLC6A4TDP1C5AR1ALDH1A1

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-2021127337-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 — — WO disclosed
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