SCHEMBL15463549

SCHEMBL15463549

CCOC(=O)c1ccc2c(c1)-c1ccccc1C2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.64
GABRD O14764 1/20 0.64
GABRA1 P14867 1/20 0.64
GABRB1 P18505 1/20 0.64
GABRG2 P18507 1/20 0.64
GABRB3 P28472 1/20 0.64
GABRA5 P31644 1/20 0.64
GABRA3 P34903 1/20 0.64
GABRA2 P47869 1/20 0.64
GABRB2 P47870 1/20 0.64
GABRA4 P48169 1/20 0.64
GABRE P78334 1/20 0.64
GABRA6 Q16445 1/20 0.64
GABRG1 Q8N1C3 1/20 0.64
GABRG3 Q99928 1/20 0.64
GABRQ Q9UN88 1/20 0.64
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
SRD5A2 P31213 1/20 0.53
MAPT P10636 5/20 0.52

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
Fluorene SCHEMBL28175311 0.84 MEN1 (0.58) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL22524482 0.83 TRPA1 (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL19936078 0.80 SRD5A2 (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29851592 0.80 SRD5A2 (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28171876 0.79 TRPA1 (0.60) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6536547 0.78 SRD5A1 (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL19936045 0.78 SRD5A2 (0.55) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL19936049 0.78 SRD5A2 (0.55) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13236269 0.78 MAPT (0.70) SRD5A2MAPTKDM4EALDH1A1HPGD
SCHEMBL28171211 0.78 SRD5A2 (0.54) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115583948-A Novel crystalline forms of POL1 inhibitor 皮梅拉股份有限公司 2023-01-10 CN disclosed
CN-110709400-A Novel crystalline forms of POL1 inhibitor 皮梅拉股份有限公司 2020-01-17 CN disclosed
CN-106459068-B Novel compositions, uses and processes for their preparation 皮梅拉股份有限公司 2019-01-22 CN disclosed
CN-106995443-A New compositions, purposes and the method for preparing them 皮梅拉股份有限公司 2017-08-01 CN disclosed
CN-106459068-A Novel compositions, uses and processes for their preparation 皮梅拉股份有限公司 2017-02-22 CN disclosed
EP-1991526-B1 Tetracyclic indole derivatives as in vivo imaging agents and having peripheralbenzodiazepine receptor affinity (PBR) HAMMERSMITH IMANET LTD (GB) 2014-02-12 EP disclosed