SCHEMBL27589977

SCHEMBL27589977

CCOC(=O)Cc1c(-c2ccc(C)cc2)nc2ncc(C)cn12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC2A2 P11168 1/20 0.50
▸ GABRA1 P14867 3/20 0.49
▸ GABRB2 P47870 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ ALB P02768 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CHRM1 P11229 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ GABRB1 P18505 1/20 0.49
▸ GABRG2 P18507 1/20 0.49
▸ GABRB3 P28472 1/20 0.49
▸ GABRA3 P34903 1/20 0.49
▸ ADRA1A P35348 1/20 0.49
▸ OPRK1 P41145 1/20 0.49
▸ HTR2B P41595 1/20 0.49
▸ GABRA2 P47869 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.42

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
SCHEMBL7505252 0.89 KDM4E (0.47) SLC2A2GABRA1GABRB2KDM4ELMNA
SCHEMBL27571713 0.87 SLC2A2 (0.48) SLC2A2GABRA1GABRB2KDM4ELMNA
SCHEMBL7503171 0.85 KDM4E (0.50) GABRA1GABRB2KDM4ELMNAALB
SCHEMBL6215583 0.85 GABRA1 (0.69) GABRA1GABRB2KDM4ELMNAALB
SCHEMBL27500927 0.82 GABRA1 (0.72) SLC2A2GABRA1GABRB2KDM4ELMNA
SCHEMBL7507412 0.75 ALDH1A1 (0.47) GABRA1GABRB2KDM4ELMNAALB
SCHEMBL2935216 0.75 GABRA1 (0.61) SLC2A2GABRA1GABRB2KDM4ELMNA
SCHEMBL2934656 0.75 GABRA1 (0.61) SLC2A2GABRA1GABRB2KDM4ELMNA
SCHEMBL6218191 0.73 AKT1 (0.42) GABRA1GABRB2KDM4ELMNAALB
SCHEMBL2930904 0.71 GABRA1 (0.70) SLC2A2GABRA1GABRB2KDM4ELMNA

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-1413212-A Process for preparation of 6-methyl-2-(4-methyl-phenyl)-imidazo [1,2-a] pyrimidine-3-(N,N-dimethyl-acetamide) and intermediates EGYT GYOGYSZERVEGYESZETI GYAR (HU) 2003-04-23 — — CN disclosed
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