SCHEMBL7885548

SCHEMBL7885548

c1ccc(CN(Cc2ccccc2)C2CCCCCC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ G6PC1 P35575 1/20 0.54
▸ CYP2D6 P10635 3/20 0.51
▸ CYP2C9 P11712 3/20 0.51
▸ HSD17B10 Q99714 3/20 0.51
▸ TSHR P16473 1/20 0.51
▸ SLC6A2 P23975 2/20 0.50
▸ SLC6A4 P31645 2/20 0.50
▸ YTHDC1 Q96MU7 1/20 0.50
▸ AGER Q15109 3/20 0.49
▸ MTNR1A P48039 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ HRH4 Q9H3N8 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL28410816 1.00 G6PC1 (0.54) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL515999 1.00 G6PC1 (0.54) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL3373138 0.98 SLC6A2 (0.51) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL13017781 0.96 SLC6A2 (0.53) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL8812187 0.89 G6PC1 (0.46) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL3376962 0.89 YTHDC1 (0.58) G6PC1TSHRSLC6A2SLC6A4YTHDC1
SCHEMBL10708848 0.89 G6PC1 (0.49) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL9455273 0.89 GRIN2B (0.58) G6PC1HSD17B10SLC6A2SLC6A4AGER
SCHEMBL18828701 0.87 LTA4H (0.59) G6PC1CYP2D6CYP2C9HSD17B10TSHR
SCHEMBL11880676 0.87 KMT2A (0.49) G6PC1CYP2D6CYP2C9HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119219503-A Synthesis method of amine compound 铜陵学院 2024-12-31 — — CN disclosed
WO-2010108067-A1 ALPHA-(N-BENZENESULFONAMIDO)CYCLOALKYL DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2010-09-23 — — WO disclosed
CN-101560167-A Alpha-n-methylation of amino acids HOFFMANN LA ROCHE (CH) 2009-10-21 — — CN disclosed
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