SCHEMBL3164458

SCHEMBL3164458

Cn1c(C(=O)O)cc2cccc(CN3CCN(C(=O)C(N)=O)CC3)c21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MCL1 Q07820 3/20 0.39
ALDH1A1 P00352 6/20 0.37
KDM4E B2RXH2 5/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PARP1 P09874 1/20 0.37
GAA P10253 1/20 0.36
CMA1 P23946 1/20 0.36
LMNA P02545 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
SCHEMBL3164512 0.85 FAAH (0.41) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL3165433 0.85 ALDH1A1 (0.42) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL3267160 0.83 FAAH (0.38) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL3162673 0.83 FAAH (0.46) FAAHMEN1KMT2AALDH1A1KDM4E
SCHEMBL27856260 0.83 HTR1A (0.42) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL690572 0.82 RORC (0.40) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL692867 0.81 LMNA (0.44) MCL1ALDH1A1KDM4ECMA1LMNA
SCHEMBL690228 0.81 EPHX2 (0.42) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL689275 0.81 EPHX2 (0.42) FAAHMEN1KMT2AMCL1ALDH1A1
SCHEMBL3228834 0.81 EPHX2 (0.42) FAAHMEN1KMT2AMCL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786801-B1 2-ARYLCARBAMOYL-INDOLES AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMA (US) 2010-03-10 EP disclosed
US-7470692-B2 Cytokine inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2008-12-30 US disclosed
US-20060046986-A1 Cytokine inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-03-02 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-20060046986-A1 Cytokine inhibitors IL1B, TNF, IL1A FAAH 2417/4885MEN1 4481/4885KMT2A 4794/4885

“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.