Geniposide

SCHEMBL17776267

COC(=O)C1=COC(O[C@H]2OC(CO)[C@@H](O)[C@H](O)C2O)C2C(CO)=CCC12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	PTPN1	P18031	8/20	0.70

▸	STAT3	P40763	8/20	0.63

▸	MEN1	O00255	1/20	0.57

▸	MAPT	P10636	1/20	0.57

▸	KMT2A	Q03164	1/20	0.57

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
Geniposide SCHEMBL16264978	1.00	PTPN1 (0.70)	PTPN1STAT3MEN1MAPTKMT2A
Geniposide SCHEMBL21765150	1.00	PTPN1 (0.70)	PTPN1STAT3MEN1MAPTKMT2A
Geniposide SCHEMBL28006822	1.00	PTPN1 (0.70)	PTPN1STAT3MEN1MAPTKMT2A
Genameside C SCHEMBL29425806	0.95	PTPN1 (0.65)	PTPN1STAT3
Genipin Gentiobioside SCHEMBL28007135	0.95	PTPN1 (0.64)	PTPN1STAT3
Genameside D SCHEMBL29425843	0.92	PTPN1 (0.60)	PTPN1STAT3
SCHEMBL29239574	0.90	PTPN1 (0.59)	PTPN1STAT3MEN1MAPTKMT2A
SCHEMBL29425894	0.90	PTPN1 (0.59)	PTPN1STAT3
SCHEMBL31228857	0.90	PTPN1 (0.59)	PTPN1STAT3MEN1MAPTKMT2A
SCHEMBL30904657	0.90	PTPN1 (0.64)	PTPN1STAT3MEN1MAPTKMT2A

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
US-20160145482-A1	COMPOSITIONS FOR TREATING SUBTERRANEAN FORMATIONS	HALLIBURTON ENERGY SERVICES, INC. (US)	2016-05-26	—	—	US	disclosed
US-20160145482-A1	COMPOSITIONS FOR TREATING SUBTERRANEAN FORMATIONS	HALLIBURTON ENERGY SERVICES, INC. (US)	2016-05-26	—	—	US	disclosed