SCHEMBL14909398

SCHEMBL14909398

CCCC(N)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.49
DRD3 P35462 1/20 0.49
ALDH1A1 P00352 3/20 0.46
ELANE P08246 1/20 0.44
KMT2A Q03164 2/20 0.43
CASP3 P42574 2/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
GLS O94925 1/20 0.42
MAPK1 P28482 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
SCHEMBL14909397 1.00 LTA4H (0.49) LTA4HDRD3ALDH1A1ELANEKMT2A
Hydrochloric Acid SCHEMBL5966923 0.98 LTA4H (0.48) LTA4HDRD3ALDH1A1ELANEKMT2A
SCHEMBL3378584 0.92 LTA4H (0.46) LTA4HDRD3ALDH1A1ELANEKMT2A
Hydrochloric Acid SCHEMBL18109315 0.90 LTA4H (0.45) LTA4HDRD3ALDH1A1ELANEKMT2A
Hydrochloric Acid SCHEMBL18109317 0.90 LTA4H (0.45) LTA4HDRD3ALDH1A1ELANEKMT2A
SCHEMBL3384205 0.89 KMT2A (0.49) LTA4HDRD3ALDH1A1ELANEKMT2A
SCHEMBL14910316 0.89 KMT2A (0.49) LTA4HDRD3ALDH1A1ELANEKMT2A
SCHEMBL18756303 0.84 LTA4H (0.51) LTA4HALDH1A1ELANEKMT2ACASP3
SCHEMBL18085400 0.82 DRD3 (0.49) DRD3ALDH1A1KMT2ACASP3CA12
SCHEMBL14928392 0.82 DRD3 (0.49) DRD3ALDH1A1KMT2ACASP3CA12

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 6 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
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-8772320-B2 2014-07-08 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

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 LTA4H 1806/4885DRD3 1880/4885ALDH1A1 1638/4885

“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.