SCHEMBL8936552

SCHEMBL8936552

O=c1[nH]c(=O)n([C@@H]2C[C@H](O)[C@@H](CO)O2)cc1-c1cccs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
TK1 P04183 2/20 0.61
ALOX12 P18054 1/20 0.58
ADRA1A P35348 1/20 0.58
TK2 O00142 1/20 0.57
P2RY2 P41231 1/20 0.56

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
SCHEMBL1635430 1.00 LMNA (0.61) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL1635432 1.00 LMNA (0.61) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL30698162 1.00 LMNA (0.61) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL5982470 0.84 TYMS (0.76) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL5872464 0.84 TYMS (0.76) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL5982466 0.84 TYMS (0.76) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL13273335 0.84 TYMS (0.76) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL5872460 0.84 TYMS (0.76) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL19777590 0.84 TYMS (0.76) LMNASMN1; SMN2TK1ALOX12ADRA1A
SCHEMBL21067666 0.82 TK1 (0.60) LMNASMN1; SMN2TK1ALOX12ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5576429-A HUMAN T-CELL LEUKEMIA/LYMPHOMA VIRICIDE; ANTITUMOR AGENT MEDIVIR AB (SE) 1996-11-19 US disclosed
EP-0357571-B1 Pyrimidine nucleosides MEDIVIR AB (SE) 1996-04-03 EP disclosed
EP-0691333-A2 Pyrimidine derivatives, process for their preparation and their use as precursors Medivir Aktiebolag (SE) 1996-01-10 EP disclosed
US-5440040-A Drug for Aids therapy; viricides MEDIVIR AB (SE) 1995-08-08 US disclosed
EP-0357571-A2 Pyrimidine nucleosides Medivir Aktiebolag (SE) 1990-03-07 EP disclosed
WO-1989012061-A1 PYRIMIDINE NUCLEOSIDES AND INTERMEDIATES MEDIVIR AB (SE) 1989-12-14 WO disclosed