SCHEMBL4105262

SCHEMBL4105262

Cc1ccc(CNC(=O)N2CCC(Oc3ccc(F)cc3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.66
EPHX2 P34913 5/20 0.61
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
SMN1; SMN2 Q16637 1/20 0.52
PKM P14618 1/20 0.51
POLB P06746 2/20 0.50

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
SCHEMBL4101221 0.91 EPHX2 (0.61) CHRNA7EPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL13873498 0.91 EPHX2 (0.64) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL12466289 0.89 EPHX2 (0.61) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL4106438 0.87 EPHX2 (0.60) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL7092551 0.87 EPHX2 (0.57) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL7096653 0.87 EPHX2 (0.59) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL13890321 0.87 EPHX2 (0.59) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL13873500 0.84 EPHX2 (0.61) CHRNA7EPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL13873499 0.84 EPHX2 (0.61) CHRNA7EPHX2ALDH1A1TSHRMEN1
SCHEMBL4114824 0.84 EPHX2 (0.70) CHRNA7EPHX2ALDH1A1TSHR

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
US-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 US disclosed
US-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 US disclosed
US-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 US disclosed
EP-1996545-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME Boehringer Ingelheim International GmbH (DE) 2008-12-03 EP disclosed
WO-2007106705-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-09-20 WO disclosed
WO-2007106705-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-09-20 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 (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-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same EPHX1, EPHX2, NCEH1 CHRNA7 3460/4885EPHX2 2/4885ALDH1A1 385/4885

“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.