SCHEMBL13873758

SCHEMBL13873758

O=C(NCCc1ccc(-c2ccccc2)cc1)N1CCC(Cc2ccccn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.56
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 3/20 0.47
GRIN2B Q13224 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
POLB P06746 1/20 0.46
CHRM4 P08173 1/20 0.46
FAAH O00519 2/20 0.44
HTR2B P41595 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43

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
SCHEMBL13873554 0.94 EPHX2 (0.59) EPHX2MEN1KMT2AKDM4EGRIN2B
SCHEMBL13873921 0.89 EPHX2 (0.57) EPHX2MEN1KMT2AKDM4EGRIN2B
SCHEMBL13873753 0.87 ALDH1A1 (0.53) EPHX2MEN1KMT2AGRIN2BSMN1; SMN2
SCHEMBL13873555 0.84 EPHX2 (0.55) EPHX2MEN1KMT2AKDM4EGRIN2B
SCHEMBL13873553 0.82 ALDH1A1 (0.59) EPHX2MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13873865 0.82 MEN1 (0.54) EPHX2MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL14413649 0.81 EPHX2 (0.51) EPHX2MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13873748 0.80 EPHX2 (0.56) EPHX2KDM4EGRIN2BNPC1RAB9A
SCHEMBL13873409 0.80 EPHX2 (0.54) EPHX2KDM4EGRIN2BCHRM4NPC1
SCHEMBL13873556 0.80 EPHX2 (0.52) EPHX2MEN1KMT2AKDM4EGRIN2B

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
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
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 EPHX2 2/4885MEN1 4174/4885KMT2A 3145/4885

“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.