SCHEMBL31726005

SCHEMBL31726005

Cc1cc(Br)c2c(c1)N(C)CCO2

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.35
PKM P14618 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
FGB P02675 1/20 0.34
TP53 P04637 1/20 0.33
POLB P06746 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL23729551 0.84 L3MBTL1 (0.37) HTR6PKML3MBTL1FGBTP53
SCHEMBL16404598 0.79 HTR6 (0.40) HTR6PKML3MBTL1POLBALDH1A1
SCHEMBL16803621 0.77 L3MBTL1 (0.39) PKML3MBTL1FGBTP53POLB
SCHEMBL27433481 0.76 TP53 (0.39) HTR6PKML3MBTL1FGBTP53
SCHEMBL7270099 0.74 KDM4E (0.40) HTR6ALDH1A1MEN1KMT2A
SCHEMBL22717412 0.74 NOTUM (0.39) HTR6PKML3MBTL1FGBCYP11B1
SCHEMBL4495102 0.72 HTR6 (0.66) HTR6PKMMEN1KMT2A
SCHEMBL18652293 0.71 PKM (0.38) PKML3MBTL1FGBTP53POLB
SCHEMBL13681599 0.71 GRM5 (0.36) ALDH1A1TDP1CYP11B1CYP11B2MEN1
SCHEMBL31726035 0.71 DRD2 (0.32) HTR6PKML3MBTL1MEN1KMT2A

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-2025235763-A1 FLUORESCENT PROBES AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-11-13 WO disclosed