SCHEMBL14910044

SCHEMBL14910044

CCOCCOCCNc1cccc2cc(Br)cnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
APAF1 O14727 2/20 0.36
GRM5 P41594 1/20 0.36
POLB P06746 2/20 0.36
BLM P54132 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDR P35968 1/20 0.36
SRC P12931 1/20 0.34
HSP90AA1 P07900 5/20 0.34
HSP90AB1 P08238 5/20 0.34
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
ALDH1A1 P00352 3/20 0.33
UTS2R Q9UKP6 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TP53 P04637 1/20 0.33
LMNA P02545 1/20 0.33
TDP2 O95551 1/20 0.33

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
SCHEMBL10077040 0.86 SMN1; SMN2 (0.44) NCF1MEN1KMT2AAPAF1POLB
SCHEMBL3382495 0.73 KDR (0.41) MEN1KMT2AAPAF1POLBBLM
SCHEMBL8251618 0.73 KMT2A (0.40) NCF1MEN1KMT2APOLBKDM4E
SCHEMBL14909228 0.71 PRKCQ (0.41) MEN1KMT2AAPAF1POLBBLM
SCHEMBL7733714 0.69 MAPT (0.45) NCF1POLBL3MBTL1SRCHSP90AA1
SCHEMBL18238944 0.68 MCHR1 (0.54) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL14908693 0.68 HSP90AA1 (0.51) MEN1KMT2APOLBBLML3MBTL1
SCHEMBL13127890 0.68 MAPT (0.60) MEN1KMT2AL3MBTL1HSP90AA1KDM4E
SCHEMBL8253940 0.67 KMT2A (0.39) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL23713447 0.66 KDM4E (0.35) MEN1KMT2APOLBL3MBTL1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2589592-B1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM CORP (JP) 2018-08-22 EP disclosed
CN-102958918-B Novel tobacco amide derivatives or its salt FUJIFILM CORP. (JP) 2015-12-09 CN disclosed
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8772320-B2 2014-07-08 US disclosed
US-8772320-B2 2014-07-08 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 US disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 EP disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 EP disclosed
CN-102958918-A Novel nicotinamide derivatives or salts thereof FUJIFILM CORP 2013-03-06 CN 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-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, CD38, BTK NCF1 288/4885MEN1 2870/4885KMT2A 1162/4885

“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.