SCHEMBL31433592

SCHEMBL31433592

C[C@H]1CNCCN1CC1CCN(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
CYP2C19 P33261 1/20 0.52
GRIN2B Q13224 11/20 0.50
CYP2D6 P10635 4/20 0.49
CYP2C9 P11712 4/20 0.49
HTT P42858 1/20 0.47
CYP3A4 P08684 3/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FAAH O00519 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
SCHEMBL23860581 0.86 HTR2C (0.62) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL26927172 0.86 HTR2C (0.62) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL31639764 0.86 HTR2C (0.62) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL13661307 0.84 SMN1; SMN2 (0.57) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL25305267 0.82 SMN1; SMN2 (0.61) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL26926920 0.82 SMN1; SMN2 (0.55) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL26924710 0.82 SMN1; SMN2 (0.55) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL26924703 0.82 SMN1; SMN2 (0.55) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL29928413 0.81 HTR2C (0.51) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL29928438 0.81 HTR2C (0.50) HTR2CSMN1; SMN2NPC1RAB9ACYP2C19

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-2025050016-A1 TRICYCLIC QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS Treeline Biosciences, Inc. (US) 2025-03-06 WO disclosed