SCHEMBL15416014

SCHEMBL15416014

Cc1[c]nccc1N1CCNCC1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
MAP4K1 Q92918 1/20 0.33
SOS1 Q07889 1/20 0.33
PIM1 P11309 2/20 0.32
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 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
SCHEMBL21326645 0.83 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3SOS1PIM1
SCHEMBL15416015 0.80 MAP4K1 (0.37) SLC6A2SLC6A4SLC6A3MAP4K1PIM1
SCHEMBL1856407 0.75 ADRB1 (0.47) SLC6A4
SCHEMBL15415226 0.74 PIM1 (0.36) SLC6A2SLC6A4SLC6A3MAP4K1PIM1
SCHEMBL15415610 0.71 MAP4K1 (0.32) SLC6A2SLC6A4SLC6A3MAP4K1SOS1
SCHEMBL3653056 0.71 ADRB1 (0.54)
SCHEMBL31176347 0.71 ADRB1 (0.54)
SCHEMBL20038317 0.71 RECQL (0.37) SLC6A2SLC6A4SLC6A3MAP4K1SOS1
SCHEMBL15415456 0.71 PIM1 (0.38) SLC6A2SLC6A4SLC6A3MAP4K1PIM1
Hydrochloric Acid SCHEMBL5913602 0.70 ADRB1 (0.53)

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
US-9550737-B2 TNF -α modulating benzimidazoles UCB BIOPHARMA SPRL (BE) 2017-01-24 US disclosed
US-9475820-B2 Substituted imidazo[1,2-a]pyrazines as TNF activity modulators UCB BIOPHARMA SPRL (BE) 2016-10-25 US disclosed
US-20150191482-A1 Imidazopyrazine Derivatives as Modulators of TNF Activity UCB BIOPHARMA SPRL (BE) 2015-07-09 US disclosed
US-20150152065-A1 TNF -Alpha Modulating Benzimidazoles UCB BIOPHARMA SPRL (BE) 2015-06-04 US disclosed
EP-2872511-A1 IMIDAZOPYRAZINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SPRL (BE) 2015-05-20 EP disclosed
EP-2858983-A1 TNF -ALPHA MODULATING BENZIMIDAZOLES UCB Biopharma SPRL (BE) 2015-04-15 EP disclosed
WO-2014009296-A1 IMIDAZOPYRAZINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB PHARMA S.A. (BE) 2014-01-16 WO disclosed
WO-2013186229-A1 TNF -ALPHA MODULATING BENZIMIDAZOLES UCB PHARMA S.A. (BE) 2013-12-19 WO 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 (2 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-20150152065-A1 TNF -Alpha Modulating Benzimidazoles TNF, TNFRSF1A, NFKBIA SLC6A2 3471/4885SLC6A4 2058/4885SLC6A3 3705/4885
US-20150191482-A1 Imidazopyrazine Derivatives as Modulators of TNF Activity TNF, TNFRSF1A, NFKBIA SLC6A2 4099/4885SLC6A4 3442/4885SLC6A3 4138/4885

“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.