SCHEMBL31670281

SCHEMBL31670281

CCOC(=O)c1c(C)nc2cccc(OC[C@@H](NC(=O)c3ccc4c(c3)OCCO4)C(C)C)c2c1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.44
▸ NPC1 O15118 6/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ MAPT P10636 5/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TP53 P04637 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ KLF5 Q13887 1/20 0.40
▸ PKM P14618 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ TAS1R3 Q7RTX0 2/20 0.39
▸ TAS1R1 Q7RTX1 2/20 0.39
▸ LMNA P02545 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL31670294 0.92 RAB9A (0.45) RAB9ANPC1HSP90AA1MAPTALDH1A1
SCHEMBL620831 0.92 NPC1 (0.41) RAB9ANPC1HSP90AA1MAPTKDM4E
SCHEMBL620832 0.92 NPC1 (0.41) RAB9ANPC1HSP90AA1MAPTKDM4E
SCHEMBL31670296 0.90 SMN1; SMN2 (0.49) RAB9ANPC1HSP90AA1MAPTALDH1A1
SCHEMBL31670297 0.87 CTNNB1 (0.35) MAPTALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL28453876 0.86 GABRP (0.37) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL28453875 0.86 GABRP (0.37) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL28455506 0.85 GABRP (0.37) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL28455508 0.85 GABRP (0.37) RAB9ANPC1MAPTALDH1A1KDM4E
SCHEMBL619807 0.84 NPC1 (0.42) RAB9ANPC1HSP90AA1MAPTKDM4E

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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