SCHEMBL8917568 — predicted protein targets

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CA1	P00915	1/20	0.38

▸	CA2	P00918	1/20	0.38

▸	CA4	P22748	1/20	0.38

▸	MT-CO2	P00403	4/20	0.38

▸	ALOX5	P09917	4/20	0.38

▸	KMT2A	Q03164	1/20	0.37

▸	CREBBP	Q92793	1/20	0.32

▸	NPC1	O15118	1/20	0.30

▸	LMNA	P02545	1/20	0.30

▸	RAB9A	P51151	1/20	0.30

▸	SMN1; SMN2	Q16637	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
SCHEMBL22924639	0.83	MT-CO2 (0.43)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL4374227	0.83	MT-CO2 (0.46)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL10719777	0.83	MT-CO2 (0.46)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL6535460	0.83	MT-CO2 (0.46)	CA1CA2CA4MT-CO2ALOX5
Ethylene SCHEMBL9360523	0.78	MT-CO2 (0.43)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL2982970	0.78	CA1 (0.52)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL535670	0.75	CA1 (0.55)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL6764761	0.72	KMT2A (0.56)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL6769544	0.72	KMT2A (0.56)	CA1CA2CA4MT-CO2ALOX5
SCHEMBL7706356	0.72	KMT2A (0.56)	CA1CA2CA4MT-CO2ALOX5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0805682-A1	DERMATOLOGICAL USE OF VITAMIN D DERIVATIVES	F. HOFFMANN-LA ROCHE AG (CH)	1997-11-12	—	—	EP	disclosed
WO-1996022776-A1	DERMATOLOGICAL USE OF VITAMIN D DERIVATIVES	F. HOFFMANN-LA ROCHE AG (CH)	1996-08-01	—	—	WO	disclosed