SCHEMBL8399705

SCHEMBL8399705

CNCCOP(=O)(OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O)OP(=O)(O)O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 10/20 0.58
TSHR P16473 1/20 0.58
GLA P06280 1/20 0.58
P2RY6 Q15077 6/20 0.55
P2RY4 P51582 5/20 0.54
LMNA P02545 1/20 0.53
THRB P10828 1/20 0.53
MTOR P42345 1/20 0.53
MDM2 Q00987 1/20 0.53
NCOA1 Q15788 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
ST6GAL1 P15907 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
SCHEMBL11138670 0.90 P2RY2 (0.70) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL597403 0.89 P2RY2 (0.62) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL28272571 0.89 P2RY2 (0.68) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL6402546 0.88 TSHR (0.65) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL8399850 0.88 P2RY2 (0.58) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL4316734 0.87 P2RY2 (0.64) P2RY2TSHRGLAP2RY6P2RY4
Cytarabine 5'-Phosphate SCHEMBL28968855 0.84 P2RY2 (0.69) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL7148623 0.84 P2RY2 (0.60) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL14125515 0.84 P2RY2 (0.62) P2RY2TSHRGLAP2RY6P2RY4
SCHEMBL154172 0.83 P2RY2 (0.76) P2RY2P2RY6P2RY4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5872108-A Reduction of infarct volume using citicoline INTERNEURON PHARMACEUTICALS, INC. (US) 1999-02-16 US claimed
US-5827832-A Method of protecting brain tissue from cerebral infarction subsequent to ischemia INTERNEURON PHARMACEUTICALS, INC. (US) 1998-10-27 US claimed
US-5801160-A Method of protecting brain tissue from cerebral infarction subsequent to ischemia INTERNEURON PHARMACEUTICALS, INC. (US) 1998-09-01 US claimed
US-4386078-A CYTIDINE DIPHOSPHOETHANOLAMINES AND CYTIDINEDIPHOSPHOCHOLINE; STROKE, CARDIOVASCULAR DISEASE, INJURIES THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1983-05-31 US claimed
US-4386078-A CYTIDINE DIPHOSPHOETHANOLAMINES AND CYTIDINEDIPHOSPHOCHOLINE; STROKE, CARDIOVASCULAR DISEASE, INJURIES THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1983-05-31 US disclosed