SCHEMBL21887980

SCHEMBL21887980

NC(=O)c1ncn([C@H]2CC[C@@H](COP(=O)(O)N3CCOCC3)O2)n1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ADORA1 P30542 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
EIF4E P06730 1/20 0.37
CYP3A4 P08684 1/20 0.37
TOP1 P11387 1/20 0.37
TSHR P16473 1/20 0.37
THPO P40225 1/20 0.37
PMP22 Q01453 1/20 0.37
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
SLC6A3 Q01959 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34

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
SCHEMBL21887954 0.86 LMNA (0.42) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21887946 0.84 LMNA (0.41) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21887982 0.84 LMNA (0.41) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21888080 0.84 LMNA (0.43) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21888256 0.83 LMNA (0.36) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21887963 0.82 LMNA (0.39) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21887944 0.82 LMNA (0.39) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21888906 0.82 LMNA (0.36) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL21887961 0.81 LMNA (0.39) LMNASMN1; SMN2ADORA1ALDH1A1GLA
SCHEMBL24024477 0.80 LMNA (0.58) LMNASMN1; SMN2ADORA1ALDH1A1GLA

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
WO-2020072931-A2 PRE-ACTIVATED NUCLEOSIDE IMPDH INHIBITORS AS ANTI-INFECTIVE DRUGS OCTAGON THERAPEUTICS INC. (US) 2020-04-09 WO disclosed