SCHEMBL21753545 — predicted protein targets

Predicted protein targets (top 17)

	gene	UniProt	supporting neighbours	confidence
▸	L3MBTL1	Q9Y468	1/20	0.36

▸	TSHR	P16473	1/20	0.35

▸	NPC1	O15118	3/20	0.34

▸	RAB9A	P51151	3/20	0.34

▸	CYP1A2	P05177	1/20	0.34

▸	HPGD	P15428	1/20	0.34

▸	CYP2C19	P33261	1/20	0.34

▸	SMN1; SMN2	Q16637	1/20	0.34

▸	TP53	P04637	1/20	0.34

▸	MAPT	P10636	1/20	0.34

▸	TXNRD1	Q16881	1/20	0.33

▸	KMT2A	Q03164	2/20	0.33

▸	MEN1	O00255	1/20	0.33

▸	SLC6A9	P48067	2/20	0.32

▸	ALOX15	P16050	1/20	0.32

▸	POLB	P06746	1/20	0.32

▸	GAA	P10253	1/20	0.32

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
SCHEMBL21753551	0.92	CHRM1 (0.36)	L3MBTL1TSHRNPC1RAB9AMAPT
SCHEMBL21753550	0.92	CHRM1 (0.36)	L3MBTL1TSHRNPC1RAB9AMAPT
SCHEMBL21753556	0.88	NPC1 (0.38)	NPC1RAB9ACYP1A2HPGDCYP2C19
SCHEMBL21753508	0.77	RAB9A (0.37)	NPC1RAB9ACYP1A2CYP2C19
SCHEMBL21753506	0.77	RAB9A (0.37)	NPC1RAB9ACYP1A2CYP2C19
SCHEMBL21753515	0.73	MEN1 (0.42)	L3MBTL1TSHRNPC1RAB9AHPGD
SCHEMBL23842604	0.71	DHODH (0.45)	NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL11377167	0.71	DHODH (0.45)	NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL21769300	0.71	DHODH (0.35)	NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL23566921	0.71	DHODH (0.35)	NPC1RAB9AHPGDSMN1; SMN2MAPT

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
WO-2020038460-A1	NOVEL QUINOLINE DERIVATIVE INHIBITOR	南京药捷安康生物科技有限公司	2020-02-27	—	—	WO	disclosed