SCHEMBL30882001

SCHEMBL30882001

Cc1c(C(=O)OC(C)(C)C)c2ccccc2c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM6 O15303 1/20 0.49
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40
GABRA6 Q16445 1/20 0.40
GABRG1 Q8N1C3 1/20 0.40
GABRG3 Q99928 1/20 0.40
GABRQ Q9UN88 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL3183313 0.80 GRM6 (0.47) GRM6GABRPGABRDGABRA1GABRB1
SCHEMBL30881971 0.79 NR4A2 (0.54) GRM6MEN1KMT2AALDH1A1HSD17B10
SCHEMBL6648807 0.78 GRM6 (0.46) GRM6GABRPGABRDGABRA1GABRB1
SCHEMBL30881958 0.76 CA12 (0.56) GRM6MEN1KMT2AGAANPC1
SCHEMBL29031850 0.76 NR4A2 (0.48) GRM6GABRPGABRDGABRA1GABRB1
SCHEMBL30472331 0.76 NR4A2 (0.48) GRM6GABRPGABRDGABRA1GABRB1
SCHEMBL482475 0.75 ALDH1A1 (0.53) GRM6GABRPGABRDGABRA1GABRB1
SCHEMBL6432563 0.75 GRM6 (0.40) GRM6GABRPGABRDGABRA1GABRB1
SCHEMBL5945357 0.75 PDE10A (0.68) MEN1KMT2AATMABCG2ALDH1A1
SCHEMBL15174105 0.73 NR4A2 (0.69) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117736095-A 9, 10-disubstituted phenanthrene compound and synthesis method thereof 河南师范大学 2024-03-22 CN disclosed