SCHEMBL26084239

SCHEMBL26084239

COc1ccc2c(c1)-c1nn(CC3CC3)cc1Cc1c(-c3nc(C4CC4)no3)ncn1-2

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 5/20 0.38
GABRB3 P28472 5/20 0.38
GABRA5 P31644 5/20 0.38
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
GPR119 Q8TDV5 2/20 0.33
AOC3 Q16853 2/20 0.33

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
SCHEMBL26084673 0.95 GABRG2 (0.37) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL26083989 0.89 GABRG2 (0.35) GABRG2GABRB3GABRA5
SCHEMBL26083962 0.89 GABRG2 (0.37) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL26084236 0.87 GABRG2 (0.36) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL26084667 0.85 GABRG2 (0.36) GABRG2GABRB3GABRA5GPR119
SCHEMBL26084671 0.83 GABRG2 (0.34) GABRG2GABRB3GABRA5
SCHEMBL26084729 0.83 GABRG2 (0.34) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL26084719 0.82 GABRG2 (0.36) GABRG2GABRB3GABRA5
SCHEMBL26083986 0.82 GABRG2 (0.35) GABRG2GABRB3GABRA5
SCHEMBL26084028 0.81 GABRG2 (0.37) GABRG2GABRB3GABRA5

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-2023192686-A1 METHODS FOR PREVENTING OR SLOWING THE PROGRESSION OF COGNITIVE DECLINE OR IMPAIRMENT IN SUBJECTS DISPLAYING NORMAL COGNITIVE PERFORMANCE Li shi jiang (US) 2023-10-05 WO disclosed