SCHEMBL4442196

SCHEMBL4442196

O=P(O)(O)O[C@@H]1[C@@H](CO)OC(O)[C@@H]1O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 1/20 0.50
ITPR3 Q14573 7/20 0.48
ITPR2 Q14571 3/20 0.48
ITPR1 Q14643 3/20 0.48
INPP5A Q14642 1/20 0.47
INPPL1 O15357 1/20 0.47
AKT1 P31749 1/20 0.47

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL4191662 1.00 SMPD1 (0.50) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL7798872 1.00 SMPD1 (0.50) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL30412792 0.94 ITPR3 (0.52) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL8859419 0.94 ITPR3 (0.52) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL30237668 0.91 SMPD1 (0.54) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL170623 0.88 SMPD1 (0.42) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL10611344 0.88 SMPD1 (0.42) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL10611354 0.88 SMPD1 (0.42) SMPD1ITPR3ITPR2ITPR1INPP5A
SCHEMBL5378658 0.87 SMPD1 (0.48) SMPD1ITPR3ITPR2ITPR1
SCHEMBL4596697 0.87 SMPD1 (0.48) SMPD1ITPR3ITPR2ITPR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11464756-B1 Mecuna pruriens, L-DOPA and 5-HTP based dietary supplements, pharmaceutical formulations and uses thereof DARM JERRY (US) 2022-10-11 US disclosed
US-9610297-B2 Stabilization of vitamin B12 BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-04-04 US disclosed
US-20160102313-A1 DOUBLE STRANDED RNA COMPOUNDS TO RHOA AND USE THEREOF QUARK PHARMACEUTICALS, INC. (US) 2016-04-14 US disclosed
US-20150328318-A1 Stabilization of Vitamin B12 BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-11-19 US disclosed
EP-2121024-B1 STABILIZATION OF VITAMIN B12 BAYER IP GMBH (DE) 2015-10-28 EP disclosed
US-9089582-B2 Stabilization of vitamin B12 BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-28 US disclosed
US-20110065665-A1 STABILIZATION OF VITAMIN B12 BAYER ANIMAL HEALTH GMBH (DE) 2011-03-17 US disclosed
CN-101631564-A Vitamin B12Stabilization of BAYER ANIMAL HEALTH GMBH 2010-01-20 CN disclosed
EP-2121024-A2 STABILIZATION OF VITAMIN B12 Bayer Animal Health GmbH (DE) 2009-11-25 EP disclosed
US-20080261914-A1 STABILIZATION OF VITAMIN B12 BAYER HEALTHCARE AG (DE) 2008-10-23 US disclosed
WO-2008113483-A2 STABILIZATION OF VITAMIN B12 BAYER ANIMAL HEALTH GMBH (DE) 2008-09-25 WO disclosed
EP-1161685-B1 METHOD FOR REDUCING FLUORESCENCE QUENCHING IN BIOASSAYS CIS BIO INT (FR) 2008-01-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150328318-A1 Stabilization of Vitamin B12 HMBS, PROC, GC SMPD1 4304/4885ITPR3 3221/4885ITPR2 3028/4885
US-20110065665-A1 STABILIZATION OF VITAMIN B12 HMBS, PROC, GC SMPD1 4304/4885ITPR3 3221/4885ITPR2 3028/4885
US-20080261914-A1 STABILIZATION OF VITAMIN B12 HMBS, PROC, GC SMPD1 4304/4885ITPR3 3221/4885ITPR2 3028/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.