SCHEMBL31670288

SCHEMBL31670288

CCOC(=O)c1c(C)nc2cccc(OC[C@@H](C)NC(=O)c3cccc(O)c3)c2c1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRG2 P18507 1/20 0.38
▸ GABRB3 P28472 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ GABRA3 P34903 1/20 0.38
▸ GABRA2 P47869 1/20 0.38
▸ GABRB2 P47870 1/20 0.38
▸ GABRA4 P48169 1/20 0.38
▸ GABRE P78334 1/20 0.38
▸ GABRA6 Q16445 1/20 0.38
▸ GABRG1 Q8N1C3 1/20 0.38
▸ GABRG3 Q99928 1/20 0.38
▸ GABRQ Q9UN88 1/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.37
▸ TAS1R1 Q7RTX1 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ MAP4K4 O95819 1/20 0.37

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
SCHEMBL28451374 1.00 GABRP (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31670286 1.00 GABRP (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28453875 0.92 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28453876 0.92 GABRP (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31670312 0.91 TAS1R3 (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28449452 0.91 TAS1R3 (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL618757 0.91 HPGD (0.38) TAS1R3TAS1R1SMN1; SMN2MAP4K4HPGD
SCHEMBL619252 0.91 HPGD (0.38) TAS1R3TAS1R1SMN1; SMN2MAP4K4HPGD
SCHEMBL618758 0.91 HPGD (0.38) TAS1R3TAS1R1SMN1; SMN2MAP4K4HPGD
SCHEMBL31670303 0.89 ALDH1A1 (0.41) 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
EP-2603098-B1 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER FIRMENICH INCORPORATED (US) 2025-08-06 — — EP disclosed
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