SCHEMBL7722613

CCCN(CCC)S(=O)(=O)c1ccc(C(=O)OCOC(=O)C2=C(c3cn4cnc(SC)c4s3)[C@H](C)[C@@H]3[C@@H]([C@@H](C)O)C(=O)N23)cc1

nearest known ligand 0.33

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	FAP	Q12884	1/20	0.33

▸	ALDH1A1	P00352	2/20	0.33

▸	LMNA	P02545	1/20	0.33

▸	CA12	O43570	5/20	0.31

▸	CA9	Q16790	5/20	0.31

▸	CA1	P00915	3/20	0.31

▸	CA2	P00918	2/20	0.30

▸	RAB9A	P51151	1/20	0.30

▸	SMN1; SMN2	Q16637	1/20	0.30

▸	SLC22A6	Q4U2R8	1/20	0.30

▸	SLC22A8	Q8TCC7	1/20	0.30

▸	ABCC2	Q92887	1/20	0.30

▸	SLC22A12	Q96S37	1/20	0.30

▸	UGT1A7	Q9HAW7	1/20	0.30

▸	SLC22A11	Q9NSA0	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
SCHEMBL7722211	0.87	FAP (0.36)	FAP
SCHEMBL7722489	0.87	FAP (0.35)	FAP
SCHEMBL7730149	0.87	FAP (0.36)	FAPABCC2
SCHEMBL7729782	0.84	FAP (0.38)	FAP
SCHEMBL7732680	0.83	FAP (0.36)	FAP
SCHEMBL7734482	0.83	FAP (0.36)	FAP
SCHEMBL7731893	0.83	FAP (0.34)	FAP
SCHEMBL7729293	0.82	FAP (0.47)	FAP
SCHEMBL7734749	0.81	FAP (0.34)	FAP
SCHEMBL7730113	0.81	FAP (0.36)	FAP

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
US-6458780-B1	IMIDAZO(5,1-B)THIAZOLE GROUP AT THE 2-POSITION ON THE CARBAPENEM RING HAVE HIGH ANTI-MICROBIAL ACTIVITIES AGAINST .BETA.-LACTAMASE PRODUCING BACTERIA, MRSA, RESISTANT-PSEUDOMONAS AERUGINOSA, PRSP, ENTEROCOCCI, AND	MEIJI SEIKA KAISHA, LTD. (JP)	2002-10-01	—	—	US	disclosed