SCHEMBL10874705

SCHEMBL10874705

CCC(Nc1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-])P(=O)(O)CC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.46
ALDH1A1 P00352 6/20 0.46
SMN1; SMN2 Q16637 7/20 0.45
HPGD P15428 2/20 0.44
KMT2A Q03164 3/20 0.42
ATM Q13315 1/20 0.42
FFAR1 O14842 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 4/20 0.42
HTT P42858 3/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 2/20 0.41
GAA P10253 1/20 0.41
XBP1 P17861 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
FAAH O00519 1/20 0.41

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
SCHEMBL10872658 0.93 LMNA (0.47) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10872655 0.87 LMNA (0.49) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10874710 0.86 LMNA (0.47) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10874415 0.85 LMNA (0.49) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10872692 0.85 LMNA (0.45) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10872656 0.85 SMN1; SMN2 (0.52) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10872664 0.81 LMNA (0.47) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10859301 0.81 RAB9A (0.50) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10955351 0.79 LMNA (0.49) LMNAALDH1A1SMN1; SMN2HPGDKMT2A
SCHEMBL10909174 0.79 MAPT (0.48) LMNARAB9AMAPTPOLBNPSR1

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
EP-0177591-A1 NOVEL PHOSPHINATES SANDOZ AG (CH) 1986-04-16 EP disclosed
WO-1985004661-A1 NOVEL PHOSPHINATES SANDOZ AG (CH) 1985-10-24 WO disclosed