SCHEMBL31737293

SCHEMBL31737293

CC(C)c1cccc(Br)c1CNO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
GABRB2 P47870 2/20 0.41
LMNA P02545 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
HTR2B P41595 1/20 0.41
GABRA2 P47869 1/20 0.41

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
SCHEMBL31737294 0.80 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL31738173 0.79 GABRA1 (0.50) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL31737608 0.79 GABRA1 (0.50) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL23447201 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL31737497 0.76 ALDH1A1 (0.43) CYP1A2HPGDKMT2ATHRBIDO1
SCHEMBL31737371 0.73 GABRA1 (0.47) GABRA1GABRB2CA2SMN1; SMN2TAAR1
SCHEMBL31737182 0.71 CA2 (0.41) GABRA1GABRB2CA2TSHRTHRB
SCHEMBL19289752 0.71 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL19289796 0.71 GABRA1 (0.50) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL9046091 0.70 GABRA1 (0.44) GABRA1GABRG2GABRB3GABRB2LMNA

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
WO-2025245119-A1 A NEW THERAPEUTIC APPROACH FOR TREATING ELEVATED LIPOPROTEIN (A) RHODE ISLAND HOSPITAL (US) 2025-11-27 WO claimed
WO-2025245119-A1 A NEW THERAPEUTIC APPROACH FOR TREATING ELEVATED LIPOPROTEIN (A) RHODE ISLAND HOSPITAL (US) 2025-11-27 WO disclosed