SCHEMBL27339263

SCHEMBL27339263

COc1ccc(CN2CCC(CN)C2)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
POLB P06746 3/20 0.55
TDP1 Q9NUW8 1/20 0.55
MAPT P10636 2/20 0.54
MAPK1 P28482 2/20 0.54
TSHR P16473 2/20 0.54
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.52
KDM4E B2RXH2 6/20 0.51
TACR1 P25103 1/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
PDE2A O00408 1/20 0.47
PTBP1 P26599 1/20 0.47

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
SCHEMBL30343566 0.87 MAPT (0.70) ALDH1A1POLBTDP1MAPTMAPK1
SCHEMBL2226923 0.81 ALDH1A1 (0.62) ALDH1A1POLBTDP1MAPTMAPK1
SCHEMBL28570071 0.80 ALDH1A1 (0.53) ALDH1A1POLBTDP1MAPTMAPK1
SCHEMBL23507475 0.80 ALDH1A1 (0.55) ALDH1A1POLBTDP1MAPTMAPK1
SCHEMBL27339265 0.80 TACR1 (0.53) MAPTTACR1
SCHEMBL27339266 0.79 KDM4E (0.60) ALDH1A1TDP1MAPTTSHRKMT2A
SCHEMBL27339267 0.79 CCR5 (0.51) POLBMAPTTSHRKMT2AMEN1
SCHEMBL5191004 0.78 TSHR (0.63) ALDH1A1POLBTDP1MAPTMAPK1
SCHEMBL9831262 0.76 KDM4E (0.64) ALDH1A1POLBTDP1MAPTMAPK1
SCHEMBL2562169 0.76 RXFP1 (0.48) ALDH1A1POLBMAPTTSHRKMT2A

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-2024107434-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed