SCHEMBL4356525

SCHEMBL4356525

O=c1nc[nH]c2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 7/20 0.67
P2RX2 Q9UBL9 5/20 0.58
P2RY1 P47900 5/20 0.56
ENPP1 P22413 2/20 0.56
P2RY12 Q9H244 1/20 0.56
P2RX4 Q99571 3/20 0.55
P2RY2 P41231 3/20 0.55
P2RX1 P51575 2/20 0.55
SRC P12931 1/20 0.55
ALDH1A1 P00352 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
P2RY6 Q15077 2/20 0.55
P2RY11 Q96G91 1/20 0.55
RNASEL Q05823 1/20 0.54
GPR17 Q13304 2/20 0.53
P2RY4 P51582 1/20 0.52
MACROD2 A1Z1Q3 1/20 0.52
SIRT6 Q8N6T7 1/20 0.52
MACROD1 Q9BQ69 1/20 0.52
TRPM2 O94759 1/20 0.52

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
SCHEMBL4368535 1.00 P2RX3 (0.67) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL24059927 0.98 P2RX3 (0.70) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL4356292 0.98 P2RX3 (0.70) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL4363151 0.98 P2RX3 (0.70) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL4363134 0.98 P2RX3 (0.70) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL20266300 0.97 P2RX3 (0.69) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL184241 0.92 P2RX3 (0.61) P2RX3P2RY1P2RY2SRCSMN1; SMN2
SCHEMBL2683124 0.92 P2RX3 (0.61) P2RX3P2RY1P2RY2SRCSMN1; SMN2
SCHEMBL29461755 0.88 P2RX3 (0.67) P2RX3P2RX2P2RY1ENPP1P2RY12
SCHEMBL316942 0.87 P2RX3 (0.57) P2RX3P2RY1ENPP1P2RY12P2RY2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4403042-A2 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME Mars, Incorporated (US) 2024-07-24 EP disclosed
EP-3229612-B1 USE OF FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS INC (US) 2024-06-26 EP disclosed
US-11185100-B2 Methods for modulating taste receptors MARS, INCORPORATED (US) 2021-11-30 US disclosed
EP-3229610-B1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS INC (US) 2021-06-09 EP disclosed
US-20190021380-A1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS, INCORPORATED (US) 2019-01-24 US disclosed
US-20180255813-A1 METHODS FOR MODULATING TASTE RECEPTORS MARS, INCORPORATED (US) 2018-09-13 US disclosed
US-20180168208-A1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS, INCORPORATED (US) 2018-06-21 US disclosed
US-20090186358-A1 Pathway Analysis of Cell Culture Phenotypes and Uses Thereof WYETH (US) 2009-07-23 US disclosed