SCHEMBL9309488

SCHEMBL9309488

O=c1[nH]c(=O)n(C2CCC(CO)C(CO)C2)cc1F

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TK1 P04183 2/20 0.52
MAPT P10636 2/20 0.47
ESR1 P03372 1/20 0.47
TSHR P16473 1/20 0.42
PMP22 Q01453 1/20 0.42
HBB P68871 1/20 0.42

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
SCHEMBL9310069 0.91 TK1 (0.60) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL600417 0.86 LMNA (0.52) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL600418 0.86 LMNA (0.52) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL600416 0.86 LMNA (0.52) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL9308235 0.83 TK1 (0.52) LMNATK1
SCHEMBL9308657 0.83 TK1 (0.74) LMNASMN1; SMN2TK1TSHRPMP22
SCHEMBL599760 0.81 LMNA (0.56) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL599759 0.81 LMNA (0.56) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL9311378 0.80 LMNA (0.62) LMNASMN1; SMN2TK1MAPTESR1
SCHEMBL9308597 0.80 LMNA (0.49) LMNASMN1; SMN2TK1MAPTESR1

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-5374625-A Bis/hydroxymethyl/cycloalkyl derivatives; viricides NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1994-12-20 US disclosed
EP-0468352-A2 Novel nucleic acid derivatives Nippon Kayaku Kabushiki Kaisha (JP) 1992-01-29 EP disclosed