SCHEMBL9068649

SCHEMBL9068649

CC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(OC(C)=O)C1OC(C)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
THRB P10828 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HIF1A Q16665 1/20 0.53
ALDH1A1 P00352 2/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MTOR P42345 1/20 0.51
MDM2 Q00987 1/20 0.51
NCOA1 Q15788 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
CA1 P00915 6/20 0.47
CA2 P00918 6/20 0.47
CA9 Q16790 6/20 0.47
CA12 O43570 5/20 0.47
CA14 Q9ULX7 5/20 0.47
TSHR P16473 1/20 0.46
PRKCA P17252 1/20 0.46
AKT1 P31749 1/20 0.46

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
SCHEMBL10813233 1.00 LMNA (0.53) LMNATHRBSMN1; SMN2HIF1AALDH1A1
SCHEMBL6536598 1.00 LMNA (0.53) LMNATHRBSMN1; SMN2HIF1AALDH1A1
SCHEMBL2238447 1.00 LMNA (0.53) LMNATHRBSMN1; SMN2HIF1AALDH1A1
Hydrochloric Acid SCHEMBL4977129 0.99 LMNA (0.52) LMNATHRBSMN1; SMN2HIF1AALDH1A1
Hydrochloric Acid SCHEMBL4977138 0.99 LMNA (0.52) LMNATHRBSMN1; SMN2HIF1AALDH1A1
Hydrochloric Acid SCHEMBL7932700 0.99 LMNA (0.52) LMNATHRBSMN1; SMN2HIF1AALDH1A1
SCHEMBL10431963 0.93 LMNA (0.50) LMNATHRBSMN1; SMN2HIF1AALDH1A1
SCHEMBL11793030 0.92 LMNA (0.57) LMNATHRBSMN1; SMN2HIF1AALDH1A1
SCHEMBL11807658 0.91 LMNA (0.48) LMNATHRBSMN1; SMN2HIF1AALDH1A1
SCHEMBL10589686 0.91 LMNA (0.48) LMNATHRBSMN1; SMN2HIF1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583117-A CARDIOVASCULAR, NERVOUS SYSTEM DISORDERS; DIABETES PRO-NEURON, INC. (US) 1996-12-10 US disclosed
US-4122251-A Process for production of 5-fluorouracil and its derivatives DAIKIN KOGYO CO., LTD. (JP) 1978-10-24 US disclosed