SCHEMBL9851812

CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](n2ncc3c(=O)[nH]cnc32)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	ALDH1A1	P00352	1/20	0.39

▸	HTT	P42858	1/20	0.34

▸	MAPT	P10636	1/20	0.34

▸	ATG7	O95352	1/20	0.33

▸	LMNA	P02545	1/20	0.33

▸	THRB	P10828	1/20	0.33

▸	SMN1; SMN2	Q16637	1/20	0.33

▸	HIF1A	Q16665	1/20	0.33

▸	MEN1	O00255	1/20	0.32

▸	KMT2A	Q03164	1/20	0.32

▸	STING1	Q86WV6	1/20	0.32

▸	TYMP	P19971	1/20	0.31

▸	P2RX3	P56373	1/20	0.31

▸	DUT	P33316	1/20	0.30

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.

Compound	similarity	top predicted	shared targets
SCHEMBL9851748	0.92	ATG7 (0.39)	ALDH1A1MAPTATG7STING1TYMP
SCHEMBL9851859	0.89	ALDH1A1 (0.39)	ALDH1A1HTTMAPTATG7LMNA
SCHEMBL9851873	0.85	ATG7 (0.48)	ALDH1A1ATG7TYMPP2RX3
SCHEMBL9851862	0.84	MEN1 (0.39)	ALDH1A1MAPTATG7LMNASMN1; SMN2
SCHEMBL9851747	0.82	SMN1; SMN2 (0.39)	ALDH1A1MAPTATG7LMNASMN1; SMN2
SCHEMBL9851701	0.81	ALDH1A1 (0.37)	ALDH1A1HTTMAPTLMNAMEN1
SCHEMBL24191447	0.80	TYMP (0.49)	ALDH1A1LMNASTING1TYMPP2RX3
SCHEMBL13320630	0.80	TYMP (0.49)	ALDH1A1LMNASTING1TYMPP2RX3
SCHEMBL21859149	0.80	TYMP (0.49)	ALDH1A1LMNASTING1TYMPP2RX3
SCHEMBL9851804	0.78	NT5E (0.41)	ALDH1A1HTTMAPTATG7LMNA

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0450102-A1	NUCLEOSIDE DERIVATIVE	Yamasa Shoyu Kabushiki Kaisha (JP)	1991-10-09	—	—	EP	disclosed