SCHEMBL11577772

SCHEMBL11577772

CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](n2cc(F)c(=O)[nH]c2=O)[C@H](O)[C@@H]1O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 4/20 0.56
P2RY14 Q15391 4/20 0.56
NT5E P21589 1/20 0.56
TK2 O00142 4/20 0.54
TSHR P16473 1/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
PMP22 Q01453 1/20 0.53
HBB P68871 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PLA2G1B P04054 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
DNPH1 O43598 1/20 0.45
ABCG2 Q9UNQ0 3/20 0.44
ABCB1 P08183 1/20 0.44

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
SCHEMBL11576522 1.00 P2RY6 (0.56) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL11577162 1.00 P2RY6 (0.56) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL11577775 1.00 P2RY6 (0.56) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL11578067 1.00 P2RY6 (0.56) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL10998262 1.00 P2RY6 (0.56) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL11578065 1.00 P2RY6 (0.56) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL10996169 0.92 P2RY6 (0.60) P2RY6P2RY14NT5ETSHRLMNA
SCHEMBL10458516 0.91 TK2 (0.60) P2RY6P2RY14NT5ETK2TSHR
SCHEMBL7241636 0.89 TK2 (0.68) TK2DNPH1ABCG2ABCB1
Hydrochloric Acid SCHEMBL9617089 0.86 P2RY6 (0.60) P2RY6P2RY14NT5ETSHRLMNA

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4097665-A Diacylnucleosides and process for preparing the same ASAHI KASEI KOGYO KABUSHIKI KAISHA (JA) 1978-06-27 US disclosed