SCHEMBL15380387

SCHEMBL15380387

NC(=O)c1ccc(C(F)(F)F)c(C(=O)c2ccccc2)c1C1CCNC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.42
SLC6A4 P31645 8/20 0.42
SLC6A3 Q01959 4/20 0.42
PARP1 P09874 2/20 0.39
HTR2C P28335 2/20 0.39
CHRM4 P08173 1/20 0.37
CYP3A4 P08684 1/20 0.37
CHRM5 P08912 1/20 0.37
CYP2D6 P10635 1/20 0.37
JAK3 P52333 1/20 0.36
PTK2 Q05397 1/20 0.36

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
SCHEMBL15537427 0.93 HTR2C (0.43) SLC6A2SLC6A4SLC6A3PARP1HTR2C
SCHEMBL15378068 0.84 PARP1 (0.38) SLC6A2SLC6A4SLC6A3PARP1JAK3
SCHEMBL17868824 0.84 PARP1 (0.42) PARP1JAK3
SCHEMBL17868823 0.80 MAPT (0.42) PARP1HTR2C
SCHEMBL15380385 0.80 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3PARP1HTR2C
SCHEMBL15380382 0.73 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3PARP1HTR2C
SCHEMBL2486805 0.73 ALDH1A1 (0.47) SLC6A4PARP1HTR2CPTK2
SCHEMBL15537425 0.72 HTR2C (0.48) SLC6A2SLC6A4SLC6A3PARP1HTR2C
SCHEMBL28482230 0.72 PARP1 (0.48) PARP1
SCHEMBL15378067 0.70 PARP1 (0.43) PARP1HTR2C

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
US-9193723-B2 NAMPT inhibitors ABBVIE INC. (US) 2015-11-24 US disclosed
US-20130303508-A1 NAMPT INHIBITORS ABBVIE INC. (US) 2013-11-14 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-20130303508-A1 NAMPT INHIBITORS NAMPT, NNMT, NAPRT SLC6A2 920/4885SLC6A4 1993/4885SLC6A3 1277/4885

“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.