SCHEMBL9261073

SCHEMBL9261073

CCOC(=O)C(O)c1c(-c2ccc(C)cc2)nc2[nH]c3ccccc3n12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ POLB P06746 2/20 0.45
▸ ADORA3 P0DMS8 2/20 0.41
▸ GABRA2 P47869 2/20 0.41
▸ GABRB2 P47870 2/20 0.41
▸ GABRP O00591 1/20 0.41
▸ GABRD O14764 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB1 P18505 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ GABRA4 P48169 1/20 0.41
▸ GABRE P78334 1/20 0.41
▸ GABRA6 Q16445 1/20 0.41
▸ GABRG1 Q8N1C3 1/20 0.41
▸ GABRG3 Q99928 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
SCHEMBL9416648 0.87 ADORA3 (0.44) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL9264131 0.81 KMT2A (0.47) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL9260636 0.76 KDM4E (0.39) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL9416616 0.76 POLB (0.44) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL9264212 0.73 ADORA3 (0.41) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL9261860 0.70 POLB (0.48) KMT2AMEN1POLBALDH1A1RAB9A
SCHEMBL9416659 0.69 KDM4E (0.38) KMT2AMEN1POLBADORA3GABRA2
Hydrochloric Acid SCHEMBL9263011 0.68 KDM4E (0.37) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL12850767 0.67 MAPT (0.43) KMT2AMEN1POLBADORA3GABRA2
SCHEMBL9262552 0.67 NR4A2 (0.45) KMT2AMEN1POLBGABRA2GABRB2

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
US-5466706-A Compounds for hypnotics, anxiety or anticonvulsants SYNTHELABO (FR) 1995-11-14 — — US disclosed
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