SCHEMBL17820946

SCHEMBL17820946

Nc1ccc2c(c1)Cc1ccc(F)c(Br)c1O2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPKAPK2 P49137 1/20 0.37
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
EGFR P00533 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TLR9 Q9NR96 1/20 0.31

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
SCHEMBL17819629 0.78 MAPKAPK2 (0.42) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL17820275 0.77 MEN1 (0.42) LMNARAB9AMAPTALDH1A1MEN1
SCHEMBL17821009 0.77 NPC1 (0.38) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL16545950 0.76 SMN1; SMN2 (0.46) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL28164465 0.75 RAB9A (0.58) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL17820332 0.71 NPC1 (0.38) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL2382432 0.67 LMNA (0.69) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL17820428 0.67 MAPT (0.41) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL735391 0.65 LMNA (0.47) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2
SCHEMBL17819964 0.64 SMN1; SMN2 (0.46) LMNARAB9ANPC1SMN1; SMN2MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3042900-B1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORP (JP) 2020-09-23 EP disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
EP-3042900-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF Fujifilm Corporation (JP) 2016-07-13 EP disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 LMNA 2540/4885RAB9A 757/4885NPC1 3926/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.