SCHEMBL16150607

SCHEMBL16150607

O=Cc1ccc(Cl)cc1OCC1CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.46
HTR2B P41595 2/20 0.46
SLC6A4 P31645 1/20 0.46
HTR6 P50406 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
PTGER1 P34995 6/20 0.43
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ERN1 O75460 1/20 0.39
PDE4B Q07343 1/20 0.39
HPGD P15428 1/20 0.38
KDM5A P29375 1/20 0.38
KDM2B Q8NHM5 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL30902367 0.88 MEN1 (0.49) HTR2CHTR2BSLC6A4HTR6TDP1
SCHEMBL18783932 0.88 MEN1 (0.49) HTR2CHTR2BSLC6A4HTR6TDP1
SCHEMBL7667342 0.83 SLC6A4 (0.51) HTR2CHTR2BSLC6A4HTR6TDP1
SCHEMBL28722986 0.82 ALDH1A1 (0.43) TDP1ERN1
SCHEMBL28722985 0.82 ALDH1A1 (0.43) TDP1ERN1
SCHEMBL5472935 0.82 SLC6A4 (0.53) HTR2CHTR2BSLC6A4HTR6PTGER1
SCHEMBL27340554 0.81 HPGD (0.40) HTR2CHTR2BPTGER1HPGDCNR2
SCHEMBL5628332 0.81 SLC6A4 (0.55) HTR2CHTR2BSLC6A4HTR6PTGER1
SCHEMBL7927301 0.80 ALDH1A1 (0.57) TDP1MEN1KMT2AERN1HPGD
SCHEMBL15786283 0.79 ERN1 (0.38) HTR2CTDP1KMT2AERN1PDE4B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed
EP-2968282-A1 HISTONE DEMENTHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 EP disclosed
WO-2014164708-A1 HISTONE DEMENTHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-10-09 WO disclosed