SCHEMBL27365895

SCHEMBL27365895

CC(C)N(C)CCc1cccc2ccc(O)cc12

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.59
MTNR1A P48039 2/20 0.52
MTNR1B P49286 2/20 0.52
MCL1 Q07820 1/20 0.49
NQO2 P16083 3/20 0.46
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44

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
Hydrochloric Acid SCHEMBL31332043 0.99 HTR2A (0.58) HTR2AMTNR1AMTNR1BMCL1NQO2
SCHEMBL31618200 0.89 HTR2A (0.59) HTR2AMTNR1AMTNR1BMCL1HTR2C
SCHEMBL28788751 0.85 HTR2A (0.64) HTR2AMTNR1AMTNR1BMCL1NQO2
SCHEMBL27366186 0.83 HTR2A (0.52) HTR2AMTNR1AMTNR1BNQO2HTR2C
SCHEMBL27367754 0.83 HTR2A (0.52) HTR2AMTNR1AMTNR1BNQO2HTR2C
SCHEMBL27366114 0.82 HTR2A (0.60) HTR2AMTNR1ANQO2HTR2CHTR2B
SCHEMBL27365826 0.81 HTR2A (0.75) HTR2AMTNR1AMTNR1BNQO2HTR2C
Hydrochloric Acid SCHEMBL31499084 0.80 HTR2A (0.59) HTR2ANQO2HTR2CHTR2B
Fumaric Acid SCHEMBL31618269 0.80 HTR2A (0.50) HTR2AMTNR1AMTNR1BNQO2HTR2C
SCHEMBL24373888 0.80 HTR2A (0.49) HTR2AMTNR1AMTNR1BMCL1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119384406-A Compounds of formula (I) 赛洛私人有限公司 2025-01-28 CN disclosed
WO-2023230649-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-12-07 WO disclosed