SCHEMBL21184589 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CCNK	O75909	17/20	0.64

▸	CDK12	Q9NYV4	17/20	0.64

▸	CCNT1	O60563	13/20	0.64

▸	CCNE1	P24864	13/20	0.64

▸	CDK2	P24941	13/20	0.64

▸	CDK9	P50750	13/20	0.64

▸	CDK7	P50613	11/20	0.64

▸	CCNH	P51946	11/20	0.64

▸	MNAT1	P51948	9/20	0.62

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
SCHEMBL21184348	0.86	CCNK (0.85)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184404	0.81	CCNK (0.85)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184552	0.80	CCNK (0.86)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184410	0.80	CCNK (0.61)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL30204015	0.80	CCNK (0.81)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184403	0.79	CCNK (0.52)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL30260936	0.79	CCNK (0.77)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL25605311	0.78	CCNK (1.00)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL29492550	0.78	CCNK (1.00)	CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL17150448	0.78	CCNK (0.73)	CCNKCDK12CCNT1CCNE1CDK2

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-2019143730-A1	INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7)	SYROS PHARMACEUTICALS, INC. (US)	2019-07-25	—	—	WO	disclosed